data_2hg7_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 2hg7 _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 ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.6 0.238 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 59.2 mt -119.39 128.76 75.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.482 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.8 mm? -67.19 -37.58 83.92 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.248 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -52.44 -46.61 66.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.471 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.65 -47.31 85.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.828 0.347 . . . . 0.0 111.12 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.4 95.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.397 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.7 mt -63.37 -40.74 90.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.63 179.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.581 ' HE1' ' HA ' ' A' ' 8' ' ' MET . 28.9 mmt -68.46 -21.93 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.74 0.305 . . . . 0.0 111.313 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -74.67 -43.44 55.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 0.0 110.541 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -90.81 -35.33 14.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.687 -175.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -121.6 84.55 42.81 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.542 0.21 . . . . 0.0 111.253 -176.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -70.9 -22.9 26.25 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.895 2.397 . . . . 0.0 112.782 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -95.94 8.36 43.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.452 -176.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.99 139.89 31.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.2 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 t -106.16 127.6 61.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 CA-C-O 121.118 0.485 . . . . 0.0 111.108 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.7 p -73.09 152.67 41.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.034 176.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.1 mtm180 65.25 17.04 10.86 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.208 0.527 . . . . 0.0 109.96 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -141.58 -73.73 0.32 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.468 -174.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -80.34 -29.71 38.0 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.453 0.644 . . . . 0.0 109.857 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -139.93 136.18 33.58 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.918 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.676 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 5.8 tp10 -96.61 127.24 42.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.273 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.7 mt -100.69 153.46 19.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.977 0.417 . . . . 0.0 110.126 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -129.71 142.2 50.75 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -94.73 109.99 21.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.114 0.483 . . . . 0.0 110.878 -176.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -79.02 -39.2 34.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.399 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.19 -42.22 1.64 Allowed Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -173.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -89.13 -5.89 57.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.856 0.836 . . . . 0.0 109.024 173.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 167.93 -177.89 41.98 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.44 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 21.3 m -120.34 130.59 54.49 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.4 p90 -124.4 -179.77 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.248 0.343 . . . . 0.0 111.231 -176.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.7 mt -84.85 121.41 36.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.365 0.602 . . . . 0.0 111.466 -173.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -96.9 -58.29 2.07 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.296 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.676 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 9.7 ttmm -113.58 138.67 49.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.206 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -125.83 112.16 15.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -116.31 11.03 14.93 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.901 0.381 . . . . 0.0 111.41 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 66.6 mt -87.69 144.29 26.73 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.901 0.382 . . . . 0.0 111.124 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -81.5 62.88 5.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.43 0.633 . . . . 0.0 109.811 174.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.22 143.65 19.69 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.577 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.31 146.89 93.34 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.578 2.185 . . . . 0.0 111.817 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.82 118.91 62.46 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.342 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.18 146.02 97.22 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.692 2.262 . . . . 0.0 112.548 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.434 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 9.2 p -93.82 171.75 8.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.738 -177.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.517 HE21 ' HG3' ' A' ' 47' ' ' GLU . 21.6 tp60 -53.78 -51.69 62.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.694 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.08 -42.56 76.89 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.276 178.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -50.02 72.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.957 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.9 mt -58.05 -44.48 87.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.682 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.517 ' HG3' HE21 ' A' ' 43' ' ' GLN . 42.6 mt-10 -65.13 -44.06 89.88 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.103 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -59.06 -43.67 91.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -61.28 -40.74 95.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.355 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.0 t-105 -66.29 -44.08 84.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.123 177.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 64.5 mt-10 -61.28 -42.4 98.59 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.887 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.34 -30.81 62.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.767 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.4 tp -77.57 -40.01 43.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.01 0.433 . . . . 0.0 111.025 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -83.47 -23.22 32.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -86.99 -16.02 36.98 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.361 0.6 . . . . 0.0 110.385 176.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 . . . . . 0 C--N 1.316 -0.875 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.309 -179.672 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.41 ' SD ' ' HG2' ' A' ' 47' ' ' GLU . 18.0 ptt? . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.054 0.454 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.67 125.76 73.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.482 HD11 HD13 ' A' ' 46' ' ' LEU . 4.0 mm? -61.04 -40.29 93.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.7 -176.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.51 ' HB2' HD13 ' A' ' 22' ' ' LEU . 15.1 t80 -55.2 -51.68 65.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.222 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -60.76 -46.86 88.83 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.369 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.85 84.15 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.337 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.457 HD13 HD13 ' A' ' 31' ' ' ILE . 70.3 mt -67.27 -45.55 85.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 -179.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.527 ' HA ' ' HE3' ' A' ' 8' ' ' MET . 2.2 mmt -65.96 -27.83 68.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.618 -176.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -75.95 -42.21 49.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.028 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.546 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 9.4 tmtt? -84.49 -36.57 22.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.827 -176.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.546 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 92.4 m-85 -127.62 88.23 54.08 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.008 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.84 -20.53 17.16 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.684 2.256 . . . . 0.0 112.266 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -86.24 5.59 33.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.892 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.65 129.67 37.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.2 t -90.37 110.28 21.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.35 0.595 . . . . 0.0 111.405 -175.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.407 ' HB3' ' CZ ' ' A' ' 20' ' ' PHE . 22.1 p -79.85 162.06 25.26 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 63.57 23.04 13.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.595 0.712 . . . . 0.0 110.116 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -145.89 -68.21 0.28 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.788 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.569 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 27.2 m-20 -88.93 -52.78 4.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.392 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.649 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 41.3 p90 -117.62 130.2 56.23 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.315 0.578 . . . . 0.0 111.411 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.757 ' HB2' ' HB2' ' A' ' 33' ' ' LYS . 2.0 mp0 -129.6 161.69 29.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.228 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.51 HD13 ' HB2' ' A' ' 4' ' ' TYR . 46.5 mt -96.57 154.38 17.31 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.621 0.724 . . . . 0.0 111.971 -173.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.565 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 1.8 tpt180 -134.24 156.37 48.52 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -89.89 120.68 31.32 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.515 -0.474 . . . . 0.0 111.115 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.598 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 23.3 t70 -92.27 -23.93 19.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.923 177.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.8 -47.97 0.99 Allowed Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.201 -175.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.585 0.707 . . . . 0.0 109.869 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 169.43 -179.87 41.71 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.596 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 m -98.29 119.27 36.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.598 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 24.6 p90 -110.04 -179.44 3.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.842 0.353 . . . . 0.0 111.034 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.457 HD13 HD13 ' A' ' 7' ' ' ILE . 35.3 mt -91.03 123.01 43.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.797 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.565 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 2.1 tm-20 -119.93 -52.99 2.19 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.757 ' HB2' ' HB2' ' A' ' 21' ' ' GLU . 2.7 mmmp? -78.6 113.67 16.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.634 173.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -134.76 110.34 9.15 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.569 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 2.1 m-20 -118.91 4.17 11.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.196 -178.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.3 mt -73.78 141.23 46.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.072 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -79.96 46.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.341 0.591 . . . . 0.0 110.803 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.48 145.82 30.28 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.881 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.24 155.21 51.72 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.653 2.235 . . . . 0.0 112.441 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 40' ' ' LEU . 4.0 mm? -71.66 137.08 83.02 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.161 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.487 ' HG2' HD21 ' A' ' 46' ' ' LEU . 74.4 Cg_endo -76.25 -177.91 4.03 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.078 2.518 . . . . 0.0 112.098 175.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.445 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 40.5 p -98.64 164.82 12.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.935 -177.041 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -60.44 -46.03 91.51 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 110.038 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.43 -48.09 74.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -56.95 -51.22 70.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.257 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.487 HD21 ' HG2' ' A' ' 41' ' ' PRO . 68.2 mt -54.88 -50.82 67.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.438 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 48.2 mt-10 -66.75 -33.35 75.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.509 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.9 m -65.87 -37.9 87.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.539 0.209 . . . . 0.0 110.705 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.463 ' CE2' ' HG3' ' A' ' 10' ' ' LYS . 22.1 m0 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.715 0.293 . . . . 0.0 110.244 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -60.92 -44.55 97.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.205 0.526 . . . . 0.0 110.03 173.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.9 mt-10 -61.38 -46.66 89.28 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.14 177.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.51 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 51.7 mt-10 -63.33 -42.28 98.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.855 178.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.1 tp -57.87 -43.94 86.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.916 0.389 . . . . 0.0 111.191 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -75.56 -33.12 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.908 -174.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.401 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 48.0 tttm -84.59 -7.48 59.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.04 0.448 . . . . 0.0 111.577 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 5.0 t30 . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.768 -174.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.483 1.218 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.41 HD11 ' N ' ' A' ' 2' ' ' ILE . 4.3 mp -78.87 104.42 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.484 0.659 . . . . 0.0 110.434 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.54 ' HB2' ' O ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -71.12 -31.92 68.36 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.265 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -51.04 -53.89 29.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.378 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.418 ' HB3' HD22 ' A' ' 53' ' ' LEU . 1.8 m-20 -64.52 -42.4 95.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.472 -178.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.414 ' HB3' ' HB3' ' A' ' 49' ' ' TRP . . . -59.87 -44.22 94.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.724 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.504 HG13 ' O ' ' A' ' 3' ' ' LEU . 83.5 mt -61.84 -42.17 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.579 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.592 ' HE2' ' HA ' ' A' ' 8' ' ' MET . 23.4 mmt -66.34 -22.88 66.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.957 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -71.93 -45.99 59.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -87.75 -42.45 12.6 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.282 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -117.84 86.96 25.93 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 116.66 -0.245 . . . . 0.0 110.788 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.64 -26.84 22.99 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.742 2.295 . . . . 0.0 112.825 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -91.33 12.13 21.44 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.457 ' O ' ' HE3' ' A' ' 8' ' ' MET . . . -95.83 132.71 40.81 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 176.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.0 t -101.56 127.15 55.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.9 m -67.22 141.85 57.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.044 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ttm-85 61.79 22.77 13.26 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.917 0.887 . . . . 0.0 111.225 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -135.0 -62.21 0.73 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.264 172.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.448 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 47.0 m-20 -89.93 -27.68 19.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.051 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -152.06 144.36 24.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.807 177.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.448 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 39.8 tt0 -126.6 136.17 52.19 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 mt -89.83 154.08 20.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.939 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.3 tpp180 -136.45 153.35 51.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.582 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -87.07 112.39 21.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.895 0.378 . . . . 0.0 110.354 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.524 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 19.4 t70 -82.51 -21.07 35.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.488 0.661 . . . . 0.0 110.262 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.12 -41.06 2.34 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -170.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -78.59 -6.46 55.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.062 -0.569 . . . . 0.0 110.444 173.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 143.07 -171.79 24.82 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.132 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.54 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.0 m -95.73 111.25 23.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.524 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -123.9 -176.39 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.905 -177.068 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.8 mt -81.12 131.56 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.863 0.363 . . . . 0.0 111.158 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -125.63 -58.95 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.572 173.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 7.5 tmtm? -87.65 125.97 34.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.389 -175.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -134.9 115.74 13.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.653 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -112.59 1.2 15.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.747 -176.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.448 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 77.7 mt -90.77 154.75 19.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -175.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -85.94 43.21 1.03 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -119.84 143.07 34.34 Favored Pre-proline 0 C--N 1.315 -0.897 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.226 -175.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.48 142.49 72.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.485 2.123 . . . . 0.0 112.283 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.407 HD11 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -76.35 125.31 87.81 Favored Pre-proline 0 N--CA 1.447 -0.609 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.521 ' HG3' ' CH2' ' A' ' 49' ' ' TRP . 33.9 Cg_endo -63.92 158.56 46.59 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 123.143 2.562 . . . . 0.0 112.386 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.419 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 60.5 p -81.62 169.73 16.69 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.454 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -60.34 -43.77 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.65 71.48 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -61.38 -45.25 95.16 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.768 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.477 HD23 HD11 ' A' ' 3' ' ' LEU . 88.1 mt -52.79 -48.8 66.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.594 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.21 -30.36 68.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.776 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.4 m -66.54 -38.14 86.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.417 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.521 ' CH2' ' HG3' ' A' ' 41' ' ' PRO . 46.4 m0 -56.42 -51.39 68.57 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.059 0.457 . . . . 0.0 109.855 175.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -59.21 -46.63 87.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.609 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.02 -46.45 90.7 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.673 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.34 -39.22 93.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.914 0.388 . . . . 0.0 110.815 178.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' A' ' 5' ' ' ASP . 52.0 tp -64.79 -44.09 91.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.16 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -73.94 -32.8 63.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.0 -177.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.6 tttm -90.29 -3.37 57.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.729 0.3 . . . . 0.0 111.787 -173.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.817 -179.018 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.48 ' HE1' HD21 ' A' ' 3' ' ' LEU . 26.3 ttt . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.855 0.359 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.65 120.39 64.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.56 -0.534 . . . . 0.0 109.56 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.48 HD21 ' HE1' ' A' ' 1' ' ' MET . 2.4 mm? -70.38 -34.02 72.09 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.1 -47.43 65.26 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.416 0.447 . . . . 0.0 110.925 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -67.81 -48.06 67.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.155 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.15 78.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.737 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 84.2 mt -62.38 -45.53 98.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.73 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.1 ttm -73.98 -24.41 59.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.294 -175.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -65.45 -43.0 91.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 174.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -79.38 -44.3 21.77 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.571 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -122.6 92.85 48.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.354 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.18 -24.24 38.44 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.905 2.404 . . . . 0.0 112.637 -177.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -94.27 10.1 35.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.603 0.716 . . . . 0.0 110.359 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . . . -80.51 95.36 6.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.455 174.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.2 t -77.92 110.31 13.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.48 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.456 ' C ' ' H ' ' A' ' 18' ' ' LYS . 18.3 m -64.99 153.55 40.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.988 176.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 16' ' ' SER . 58.8 mtt180 75.33 -33.9 0.24 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.558 0.743 . . . . 0.0 111.004 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.456 ' H ' ' C ' ' A' ' 16' ' ' SER . 42.4 tptt -80.02 -59.99 2.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.133 0.492 . . . . 0.0 110.255 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.593 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 11.7 t70 -100.25 -48.03 4.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.205 -176.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.401 ' CE1' ' HB3' ' A' ' 14' ' ' ALA . 29.8 p90 -131.08 143.83 50.97 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.198 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -129.86 132.99 46.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.423 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 36.2 mt -99.91 154.23 18.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.082 0.468 . . . . 0.0 111.38 -173.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.487 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -124.16 162.68 23.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.455 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -101.82 106.73 17.75 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.34 -40.95 22.77 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.3 -173.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.4 -58.6 0.16 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.539 -0.838 . . . . 0.0 112.417 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -94.2 -5.99 45.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.88 0.371 . . . . 0.0 111.225 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 176.53 179.56 47.02 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.048 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.445 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 10.4 p -105.7 132.45 51.82 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.426 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 52.6 p90 -146.13 -173.59 4.21 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.905 0.384 . . . . 0.0 111.458 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.423 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 23.6 mt -62.15 127.48 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.411 -170.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.487 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 10.2 tp10 -118.66 -58.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 172.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.26 126.95 43.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.12 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -139.7 111.58 7.39 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.95 -11.21 15.37 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.57 -0.452 . . . . 0.0 112.15 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.593 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 60.0 mt -55.3 133.36 49.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.149 0.5 . . . . 0.0 110.896 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 37' ' ' ARG . 54.9 mtt180 -80.12 61.05 3.84 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.532 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.38 141.4 16.32 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.497 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.01 137.16 75.73 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 123.068 2.512 . . . . 0.0 112.204 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.415 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 4.4 mm? -57.74 122.58 57.74 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.231 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 40' ' ' LEU . 18.5 Cg_endo -60.13 158.77 28.78 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.995 2.463 . . . . 0.0 112.234 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 27.5 p -99.81 162.69 12.84 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -51.79 -49.53 62.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.567 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.43 -46.82 83.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.028 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.97 -44.6 94.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.255 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 42' ' ' THR . 82.7 mt -58.47 -46.16 87.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.476 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.81 -34.85 76.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.755 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.413 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 58.8 m -62.57 -42.93 99.85 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.852 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -65.8 -37.11 85.38 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.952 0.406 . . . . 0.0 110.323 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -62.65 -45.51 92.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.005 174.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.54 -36.84 85.0 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.691 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 48' ' ' THR . 43.3 mt-10 -59.6 -46.53 88.69 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.126 174.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.13 -47.3 85.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.949 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -64.82 -28.31 69.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.227 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -95.56 2.51 54.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.99 0.424 . . . . 0.0 110.798 -178.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 . . . . . 0 C--N 1.322 -0.615 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.169 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.863 0.363 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.682 HG22 ' HB2' ' A' ' 29' ' ' SER . 2.9 mp -90.86 122.79 42.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.014 0.435 . . . . 0.0 110.253 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.442 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.2 mm? -61.83 -30.87 71.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.129 -176.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -51.23 -45.73 62.03 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.173 -177.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -63.45 -49.58 73.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.987 0.423 . . . . 0.0 111.191 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.98 -46.25 90.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.515 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -63.34 -41.77 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.15 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.491 ' HE2' ' HA ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -64.37 -29.0 70.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.944 -178.207 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -76.02 -38.17 57.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.804 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.476 ' HD3' ' CE2' ' A' ' 49' ' ' TRP . 42.8 tptt -76.17 -45.46 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.81 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -126.47 83.94 63.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.218 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.58 -21.39 46.02 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.735 2.29 . . . . 0.0 112.091 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.14 4.72 47.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.638 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -98.9 138.24 36.3 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -96.83 121.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-O 120.981 0.42 . . . . 0.0 111.018 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 138.62 58.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.689 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 69.0 13.73 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.615 0.572 . . . . 0.0 111.316 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.478 ' HG3' ' OD1' ' A' ' 19' ' ' ASP . 24.2 tptp -116.26 -72.82 0.67 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.405 177.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.478 ' OD1' ' HG3' ' A' ' 18' ' ' LYS . 3.0 m-20 -101.77 -1.05 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.301 0.572 . . . . 0.0 110.924 -179.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -148.2 124.03 10.59 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 169.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.876 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 34.2 tt0 -110.65 126.57 54.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.126 -176.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.555 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 29.8 mt -103.75 152.86 21.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.996 -173.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.555 ' HD2' ' O ' ' A' ' 22' ' ' LEU . 2.3 mpt_? -133.94 174.59 10.31 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.502 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -89.46 122.17 32.4 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.178 178.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.27 -38.77 26.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.356 0.598 . . . . 0.0 110.206 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.49 -56.99 0.47 Allowed Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.866 -176.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -97.8 -11.0 23.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.557 0.694 . . . . 0.0 109.903 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -168.23 -166.53 27.45 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.71 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.682 ' HB2' HG22 ' A' ' 2' ' ' ILE . 42.3 m -102.39 141.83 34.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.647 0.224 . . . . 0.0 110.514 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.54 177.99 7.39 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 45.1 mt -84.66 131.43 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.624 -177.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.46 -55.24 2.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.164 0.507 . . . . 0.0 109.812 174.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.876 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 4.8 ttmp? -109.91 110.18 21.05 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.382 -176.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -105.33 112.81 26.06 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -118.06 6.06 12.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.184 0.516 . . . . 0.0 110.565 -174.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 57.4 mt -81.28 149.23 29.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.9 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -83.13 40.08 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.362 0.601 . . . . 0.0 110.7 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -128.7 152.78 79.3 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.642 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.33 156.06 67.02 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.317 2.012 . . . . 0.0 111.994 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -71.91 125.32 91.61 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -61.71 159.38 33.07 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.99 2.46 . . . . 0.0 112.599 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.586 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 61.7 p -94.64 156.14 16.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.28 -178.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.0 tm0? -52.41 -45.27 65.82 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.71 0.631 . . . . 0.0 109.832 177.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.2 -51.77 68.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.608 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.7 -34.71 78.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.132 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.4 mt -54.34 -46.54 72.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.88 -26.65 59.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.2 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.8 m -63.89 -46.99 82.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.264 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.476 ' CE2' ' HD3' ' A' ' 10' ' ' LYS . 13.6 m0 -63.78 -35.45 80.65 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.08 0.467 . . . . 0.0 109.782 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -60.96 -49.22 78.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.595 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -64.11 -38.83 92.47 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.666 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.66 -48.82 77.67 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.914 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.9 tp -60.54 -22.22 63.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.128 0.49 . . . . 0.0 110.833 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.78 -46.14 10.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.231 178.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.84 -17.08 42.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 54.2 t30 . . . . . 0 C--N 1.311 -1.098 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.844 -173.472 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 ppp? . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.5 mp -112.88 128.77 69.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.13 -179.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.479 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.7 mm? -67.59 -40.52 84.79 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.791 0.329 . . . . 0.0 111.376 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.512 ' CD1' HD12 ' A' ' 22' ' ' LEU . 40.4 t80 -52.62 -47.29 67.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.995 -176.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.53 -44.61 93.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.534 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.58 -45.82 85.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.787 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.6 mt -58.86 -48.26 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.69 178.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.466 ' HA ' ' HE3' ' A' ' 8' ' ' MET . 0.0 OUTLIER -62.09 -26.38 68.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.846 -177.825 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -69.2 -49.69 54.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.321 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.628 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 86.1 tttt -77.8 -35.76 51.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.996 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -117.8 79.84 13.6 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.852 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.423 ' HD3' ' O ' ' A' ' 10' ' ' LYS . 3.4 Cg_exo -78.38 -23.3 8.81 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.964 2.443 . . . . 0.0 112.066 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -85.19 -6.48 59.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.76 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.4 127.93 34.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.521 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.8 t -82.7 121.13 35.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.093 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.3 t -69.0 143.25 54.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.191 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.401 ' HA ' ' HG2' ' A' ' 21' ' ' GLU . 81.5 mtt180 63.14 21.43 12.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.964 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -109.29 -69.64 0.85 Allowed 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.418 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -99.43 -46.21 5.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.45 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 32.8 p90 -100.68 138.16 38.12 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 175.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.454 ' CB ' ' HB3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -131.1 142.53 50.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.041 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.512 HD12 ' CD1' ' A' ' 4' ' ' TYR . 14.0 mt -101.71 144.81 29.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.842 -172.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -143.43 169.37 17.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.552 176.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -106.09 112.28 25.26 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.609 -176.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.586 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 30.8 t70 -79.64 -28.37 40.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.803 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 175.84 -95.44 0.1 Allowed Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.484 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -95.91 35.29 1.42 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.483 0.658 . . . . 0.0 109.789 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.77 148.9 7.12 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.97 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 m -99.17 129.05 45.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.586 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -134.78 -168.68 2.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.946 0.403 . . . . 0.0 110.971 -173.114 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -81.96 132.69 30.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.174 177.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -125.23 -53.67 1.61 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.454 ' HB3' ' CB ' ' A' ' 21' ' ' GLU . 58.2 tttm -94.55 122.91 37.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.875 178.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -136.47 111.01 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -118.15 3.71 12.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.249 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.7 mt -71.86 137.62 47.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -79.81 59.58 3.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.87 0.843 . . . . 0.0 110.238 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -139.76 150.58 63.4 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.136 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.57 147.85 46.59 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.187 1.925 . . . . 0.0 111.898 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.11 130.87 93.19 Favored Pre-proline 0 N--CA 1.449 -0.49 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.03 176.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.42 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 41.8 Cg_endo -68.19 168.61 18.75 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.848 2.365 . . . . 0.0 112.994 -177.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.501 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 41.1 p -104.33 165.29 11.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.546 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -57.36 -43.77 83.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.291 0.567 . . . . 0.0 109.735 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.79 -47.82 73.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.97 -1.014 . . . . 0.0 110.633 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.426 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 30.4 mt-10 -58.24 -53.42 58.48 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 176.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.8 mt -52.31 -49.09 64.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.627 -177.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.72 -33.45 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.627 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 91.8 m -64.08 -45.28 89.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.554 0.216 . . . . 0.0 110.556 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.628 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.0 m0 -63.72 -42.13 97.98 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -63.1 -44.31 96.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.801 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -62.29 -46.73 87.44 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.497 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.529 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 45.5 mt-10 -64.0 -37.35 87.1 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.861 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.9 tp -65.09 -30.03 70.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.869 0.366 . . . . 0.0 110.914 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -91.39 -39.76 11.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.091 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -88.4 -15.8 34.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.162 0.506 . . . . 0.0 111.447 -173.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.529 ' HB3' ' O ' ' A' ' 52' ' ' GLU . 9.0 t30 . . . . . 0 C--N 1.315 -0.929 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.533 176.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 ttt . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.468 ' N ' HD13 ' A' ' 2' ' ' ILE . 3.9 mp -87.13 112.62 23.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.441 HD13 HD11 ' A' ' 46' ' ' LEU . 2.9 mm? -70.13 -34.36 72.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.113 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -51.17 -49.18 61.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.861 -175.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.25 -51.09 70.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.339 -177.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.72 90.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.461 -177.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 3' ' ' LEU . 77.8 mt -63.25 -47.86 90.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.249 -178.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.4 ttm -76.25 -16.99 59.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.969 0.414 . . . . 0.0 111.012 -174.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.436 ' CD2' ' HB3' ' A' ' 49' ' ' TRP . 92.4 t80 -69.38 -44.72 70.9 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 174.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -82.07 -37.21 26.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.092 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -124.17 97.74 39.91 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 121.069 0.462 . . . . 0.0 111.226 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -66.53 -27.81 45.93 Favored 'Trans proline' 0 CA--C 1.528 0.185 0 C-N-CA 122.857 2.371 . . . . 0.0 112.567 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -87.34 8.82 22.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.667 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.509 ' HB2' ' CE1' ' A' ' 20' ' ' PHE . . . -78.71 107.06 11.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.895 0.379 . . . . 0.0 110.526 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.67 105.83 15.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.406 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m -70.03 140.97 52.94 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.441 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 71.38 12.4 6.65 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.577 177.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -116.38 -76.48 0.57 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -91.5 -31.24 16.03 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.147 0.499 . . . . 0.0 110.415 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.509 ' CE1' ' HB2' ' A' ' 14' ' ' ALA . 17.2 p90 -127.62 135.67 50.58 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 170.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -130.51 139.96 50.5 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.464 0.649 . . . . 0.0 110.557 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.0 mt -93.61 146.86 23.51 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.493 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.401 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.9 mpt_? -130.92 169.8 15.31 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 176.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -92.3 117.86 30.32 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.441 -175.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -86.82 -26.24 24.16 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 132.18 -38.31 1.91 Allowed Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.03 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -87.44 -22.34 25.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.355 0.598 . . . . 0.0 110.427 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 171.02 -160.24 32.58 Favored Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.351 177.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 m -99.24 112.3 24.49 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -116.9 173.63 6.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.442 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.6 mt -69.96 114.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.248 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.401 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 1.6 tm-20 -121.1 -53.62 2.04 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.664 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.82 116.91 32.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -129.36 111.86 13.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -114.55 3.88 15.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.921 0.391 . . . . 0.0 110.813 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.8 mt -70.66 145.58 50.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.89 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -81.79 49.03 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.144 0.497 . . . . 0.0 110.396 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.425 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . . . -146.17 140.05 15.11 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.808 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 38' ' ' ALA . 38.6 Cg_exo -61.92 148.25 93.52 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.075 2.517 . . . . 0.0 112.59 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.08 142.95 90.82 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.296 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.19 171.72 16.27 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.387 2.058 . . . . 0.0 110.963 170.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.7 p -104.6 167.77 9.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.49 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -56.61 -47.95 78.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.136 0.493 . . . . 0.0 110.021 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.11 -48.88 73.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.172 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -57.39 -49.73 75.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.303 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.441 HD11 HD13 ' A' ' 3' ' ' LEU . 91.7 mt -55.59 -47.74 76.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.046 0.45 . . . . 0.0 111.184 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -75.9 -18.0 59.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.635 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.3 m -64.92 -50.08 67.88 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.436 ' HB3' ' CD2' ' A' ' 9' ' ' TYR . 8.1 m0 -67.26 -31.74 72.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.22 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -62.09 -44.77 95.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.927 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -60.8 -46.19 91.49 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.842 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.39 -35.8 81.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.915 0.388 . . . . 0.0 111.0 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.3 tp -65.42 -38.84 91.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.667 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.71 -25.37 41.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.127 0.489 . . . . 0.0 110.435 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.434 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 43.2 tttm -87.16 18.92 3.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.244 178.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 55' ' ' LYS . 11.5 t30 . . . . . 0 N--CA 1.467 0.386 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.408 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.407 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.4 mp -104.87 115.31 46.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.492 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.2 OUTLIER -63.44 -32.76 74.29 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.096 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -52.98 -48.57 67.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.084 -176.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.6 -48.8 79.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.351 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.69 -43.78 85.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.432 178.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -67.09 -38.31 80.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.54 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.581 ' HE2' ' HA ' ' A' ' 8' ' ' MET . 15.0 mmt -68.64 -22.5 64.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.481 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -79.25 -38.31 35.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.848 0.356 . . . . 0.0 110.309 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? -80.68 -50.78 9.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.96 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -118.81 85.33 27.79 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.992 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.64 -20.85 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.624 2.216 . . . . 0.0 112.879 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -90.1 -8.34 51.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.073 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.14 141.93 58.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.327 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.43 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 33.4 t -104.12 128.44 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.14 0.495 . . . . 0.0 110.738 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 p -70.67 141.81 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.321 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 17' ' ' ARG . 43.2 mtt180 65.55 25.12 11.77 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.513 0.673 . . . . 0.0 110.705 -176.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.43 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 84.8 tttt -140.92 -60.16 0.5 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.382 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.418 ' HB3' HD23 ' A' ' 36' ' ' LEU . 33.8 m-20 -86.98 -38.36 16.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.865 176.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 p90 -152.26 149.37 28.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.043 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.58 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 66.7 tt0 -136.02 135.39 39.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.45 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 48.9 mt -117.24 155.19 29.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.863 0.363 . . . . 0.0 111.627 -170.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 29' ' ' SER . 5.6 mpt_? -124.22 173.73 8.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.017 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -98.43 119.55 37.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.655 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -81.1 -33.08 33.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.226 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.96 -36.25 3.51 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -170.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -95.33 9.41 39.97 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 173.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 134.27 -176.7 19.68 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.789 -178.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.448 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 11.1 m -84.67 130.57 34.69 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -120.42 171.43 8.54 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 110.606 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.492 HG13 ' HG ' ' A' ' 3' ' ' LEU . 62.7 mt -82.33 121.77 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.23 -176.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -108.75 -58.41 2.01 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 176.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 32.0 mmtp -99.17 131.74 44.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.516 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -133.58 111.62 10.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 175.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -114.18 1.29 14.5 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.081 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.418 HD23 ' HB3' ' A' ' 19' ' ' ASP . 76.8 mt -78.73 147.71 33.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 -177.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.7 mtp180 -87.5 36.06 0.74 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.432 177.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.23 141.1 38.81 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.006 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.79 148.73 93.05 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.826 2.35 . . . . 0.0 112.459 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.91 128.59 93.37 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.661 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.404 ' HG2' HD21 ' A' ' 46' ' ' LEU . 56.1 Cg_endo -71.23 171.67 15.57 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.546 2.164 . . . . 0.0 111.909 176.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.462 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.9 p -93.6 165.29 12.8 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.702 -177.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -59.22 -39.66 83.37 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.168 178.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.92 95.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.314 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.55 -48.48 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.879 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 42' ' ' THR . 99.7 mt -55.35 -47.2 76.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.336 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.39 -28.28 66.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.0 m -62.94 -50.76 69.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.565 0.222 . . . . 0.0 110.807 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -65.1 -38.56 91.1 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-O 120.974 0.416 . . . . 0.0 110.276 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -58.76 -49.26 78.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.714 177.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.86 -44.51 96.91 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 123.141 0.576 . . . . 0.0 111.765 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.488 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.26 -38.08 82.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.903 0.382 . . . . 0.0 110.474 177.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -69.65 -38.87 77.3 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.544 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -79.65 -13.18 59.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.898 0.38 . . . . 0.0 111.884 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 . . . . . 0 C--N 1.316 -0.862 0 CA-C-O 120.918 0.389 . . . . 0.0 111.721 -175.744 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.439 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.0 mp -104.43 111.1 32.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.929 0.395 . . . . 0.0 110.151 178.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.714 ' HG ' HG13 ' A' ' 31' ' ' ILE . 2.8 mm? -70.04 -30.59 67.91 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.4 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -50.45 -40.4 50.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.79 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -67.56 -55.3 14.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.61 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.87 86.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.57 -176.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.0 mt -64.06 -44.86 97.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.268 -177.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 69.9 mtp -81.88 -9.04 59.71 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.485 -176.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -77.39 -38.9 48.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.633 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 61.9 tttm -81.35 -38.19 27.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.239 177.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.504 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 85.1 m-85 -121.08 98.58 47.16 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.536 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.77 -24.49 68.64 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.609 2.206 . . . . 0.0 111.973 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -98.53 17.86 18.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.043 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.504 ' HB1' ' HB2' ' A' ' 11' ' ' TYR . . . -86.76 101.41 13.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.141 0.496 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 37.7 t -88.79 117.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.449 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 p -72.04 150.6 43.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.468 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 64.88 23.05 12.59 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -125.05 -72.06 0.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.037 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.7 t0 -109.25 4.83 23.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.786 0.803 . . . . 0.0 110.022 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.486 ' CE1' ' HB2' ' A' ' 14' ' ' ALA . 39.6 p90 -165.27 127.18 2.07 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 171.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -113.33 130.42 56.27 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.126 0.489 . . . . 0.0 111.169 -172.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.34 153.2 24.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.667 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.494 ' NH1' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -133.32 173.96 10.91 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.246 0.546 . . . . 0.0 111.208 176.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -99.52 123.62 43.96 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.204 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.412 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 7.1 t70 -98.19 -34.64 10.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.224 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.74 -29.14 5.94 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -174.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -100.36 -8.93 22.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.611 0.72 . . . . 0.0 109.588 175.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.8 177.42 30.89 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.776 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.2 m -96.13 115.48 27.5 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.412 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 53.5 p90 -106.17 171.24 7.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.806 -172.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.714 HG13 ' HG ' ' A' ' 3' ' ' LEU . 58.5 mt -87.45 118.71 33.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.977 176.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.494 ' HG2' ' NH1' ' A' ' 23' ' ' ARG . 8.9 tp10 -101.97 -56.55 2.25 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.78 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -121.29 113.09 19.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.336 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.433 ' CH2' HD12 ' A' ' 36' ' ' LEU . 58.1 t-105 -106.83 112.53 25.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.173 -174.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 6.1 m-20 -110.86 1.94 17.94 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -177.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.433 HD12 ' CH2' ' A' ' 34' ' ' TRP . 90.7 mt -69.57 141.42 53.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.32 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -82.59 41.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.489 0.661 . . . . 0.0 110.748 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.13 142.17 40.84 Favored Pre-proline 0 C--N 1.315 -0.935 0 CA-C-N 115.104 -0.953 . . . . 0.0 108.774 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.4 155.74 50.54 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.381 2.054 . . . . 0.0 111.962 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.8 120.55 69.75 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.598 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -62.69 168.83 9.47 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.918 2.412 . . . . 0.0 112.117 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.4 p -94.1 167.03 11.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.74 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -62.57 -44.19 96.93 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.898 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.79 -45.05 86.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.208 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -57.7 -54.11 50.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.818 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.436 ' HA ' ' CE3' ' A' ' 49' ' ' TRP . 93.3 mt -55.21 -46.21 75.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.826 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.77 -20.77 59.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -177.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 88.5 m -70.83 -44.35 66.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.107 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.633 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 9.5 m0 -64.31 -36.97 85.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.422 ' O ' ' HB2' ' A' ' 54' ' ' GLN . 62.0 t-105 -60.97 -42.75 98.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.312 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -70.51 -43.39 69.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.23 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -61.8 -40.78 96.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 58.5 tp -68.38 -34.35 75.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.525 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 50' ' ' TRP . 0.4 OUTLIER -72.61 -25.17 61.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.063 0.458 . . . . 0.0 110.541 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 74.5 tttt -78.65 -6.76 56.55 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.506 175.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.3 t30 . . . . . 0 N--CA 1.465 0.313 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.284 -174.452 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.425 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 1.3 tmt? . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.4 mp -106.28 124.52 61.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.267 -177.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.607 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 0.2 OUTLIER -65.86 -32.98 74.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.515 179.435 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.459 ' HE1' ' OG ' ' A' ' 16' ' ' SER . 81.8 t80 -52.17 -47.63 65.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.258 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.44 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 0.9 OUTLIER -60.4 -47.81 84.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.401 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.89 99.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.12 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 3' ' ' LEU . 82.1 mt -63.49 -43.25 98.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.15 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.571 ' HE2' ' HA ' ' A' ' 8' ' ' MET . 30.6 mmt -67.71 -23.29 65.26 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.165 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -81.39 -37.7 27.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.938 0.399 . . . . 0.0 110.437 177.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -82.78 -50.81 8.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.382 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -132.33 88.02 41.13 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.467 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -68.35 -13.12 36.89 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.744 2.296 . . . . 0.0 111.3 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -75.93 -13.74 60.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.875 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.9 137.63 32.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.534 ' HB ' ' HD3' ' A' ' 18' ' ' LYS . 47.7 t -99.34 129.36 49.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.89 0.376 . . . . 0.0 110.743 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.459 ' OG ' ' HE1' ' A' ' 4' ' ' TYR . 14.9 m -62.92 134.4 56.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.253 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 70.8 3.98 4.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.533 0.733 . . . . 0.0 111.553 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.534 ' HD3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -110.96 -63.84 1.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.851 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.538 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 52.5 m-20 -90.0 -17.71 27.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.288 -177.218 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.2 p90 -153.51 130.35 10.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.473 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 33.2 tt0 -109.79 126.39 53.72 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 mt -90.77 150.85 21.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.612 0.72 . . . . 0.0 111.542 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -139.68 154.75 47.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.502 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -86.3 123.7 31.84 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.057 0.456 . . . . 0.0 110.783 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.45 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 1.7 t70 -88.86 -32.69 17.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.325 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.07 -43.61 1.52 Allowed Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -79.5 -20.03 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.451 0.644 . . . . 0.0 109.579 173.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.425 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 163.72 -172.07 39.52 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.317 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -88.19 121.66 30.84 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.607 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.3 p90 -117.94 -178.06 3.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.447 -0.205 . . . . 0.0 110.447 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.423 HD13 HD13 ' A' ' 7' ' ' ILE . 31.0 mt -91.11 121.6 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.972 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -98.65 -53.33 3.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 2.8 tppp? -94.76 104.52 16.43 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.351 178.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 61.5 t-105 -87.03 108.89 19.06 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 168.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -106.91 -2.97 20.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.463 0.649 . . . . 0.0 110.41 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.538 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 73.2 mt -86.95 147.62 25.68 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.873 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.2 mtp180 -92.57 36.2 1.01 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.47 ' HB2' ' HD2' ' A' ' 39' ' ' PRO . . . -111.2 161.74 23.83 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 114.41 -1.268 . . . . 0.0 109.943 -177.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.47 ' HD2' ' HB2' ' A' ' 38' ' ' ALA . 30.8 Cg_endo -64.39 150.05 88.97 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.642 2.228 . . . . 0.0 112.468 178.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.58 134.08 51.64 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.898 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.97 164.37 33.98 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.487 2.125 . . . . 0.0 111.375 172.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.594 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 70.3 p -95.87 167.63 11.13 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.704 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.468 HE21 ' HG3' ' A' ' 47' ' ' GLU . 23.2 tp60 -55.88 -46.81 78.22 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.343 0.592 . . . . 0.0 109.534 173.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.75 70.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.847 176.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.01 -46.62 87.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.415 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 42' ' ' THR . 87.4 mt -57.08 -44.52 83.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.909 0.385 . . . . 0.0 111.023 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.468 ' HG3' HE21 ' A' ' 43' ' ' GLN . 48.6 mt-10 -75.02 -24.64 58.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.056 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.8 m -73.07 -41.43 64.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.398 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 51.2 m0 -66.58 -31.98 73.03 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -64.46 -36.11 83.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.944 174.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.11 -50.25 49.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.295 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -62.22 -32.79 73.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.694 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.44 ' CD2' ' HB3' ' A' ' 5' ' ' ASP . 44.9 tp -61.11 -43.06 99.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.036 176.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -76.65 -31.62 57.45 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.491 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -74.01 -15.17 61.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.892 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.4 t30 . . . . . 0 C--N 1.317 -0.811 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.3 179.495 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.439 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.602 HG22 ' HB2' ' A' ' 29' ' ' SER . 4.2 mp -108.47 128.86 63.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.208 -177.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.43 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -66.12 -32.55 74.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.399 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.4 ' H ' HG23 ' A' ' 2' ' ' ILE . 84.3 t80 -52.39 -45.56 65.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.685 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.36 -49.94 75.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 0.0 111.201 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.32 -45.08 95.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.295 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.29 -47.08 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.888 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.26 -29.64 70.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.83 -177.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -68.23 -45.34 73.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.048 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -81.17 -35.8 30.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.887 -178.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -121.72 89.03 47.51 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.554 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -66.39 -22.01 53.05 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.983 2.455 . . . . 0.0 112.336 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -102.8 23.99 11.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.235 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.53 106.28 18.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.512 HG12 ' HD2' ' A' ' 18' ' ' LYS . 19.5 t -76.47 113.59 15.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.153 0.502 . . . . 0.0 111.201 -175.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.3 p -66.81 139.01 57.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.742 -178.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 68.8 6.93 5.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.448 -0.797 . . . . 0.0 112.099 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.512 ' HD2' HG12 ' A' ' 15' ' ' VAL . 50.1 mttp -119.18 -55.49 2.15 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.842 0.353 . . . . 0.0 110.265 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.442 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 10.7 t70 -91.66 -50.32 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.95 178.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -120.27 141.08 50.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.646 176.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.637 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 80.4 tt0 -129.51 131.09 46.55 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -177.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 mt -112.53 153.54 27.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.796 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.408 ' HD3' ' HA ' ' A' ' 23' ' ' ARG . 9.7 tpp180 -123.12 157.01 33.83 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.421 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -98.97 132.09 44.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.085 0.469 . . . . 0.0 111.357 -171.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -90.97 -48.3 7.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.689 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.55 -47.37 0.93 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -173.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -92.4 6.19 47.92 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.654 0.74 . . . . 0.0 109.695 174.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.439 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 161.93 -164.92 35.59 Favored Glycine 0 N--CA 1.441 -0.977 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.674 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.602 ' HB2' HG22 ' A' ' 2' ' ' ILE . 18.4 m -130.16 136.34 49.17 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 46.4 p90 -120.6 173.1 7.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.986 -173.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.43 HG13 ' HG ' ' A' ' 3' ' ' LEU . 29.7 mt -95.78 137.25 24.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.507 -175.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -129.46 -22.96 2.98 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.831 0.348 . . . . 0.0 111.184 167.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.637 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 20.7 mmtp -117.15 135.7 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.417 177.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -154.43 111.67 3.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -110.39 -9.97 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.783 179.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.442 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 69.5 mt -56.62 133.27 53.59 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.174 0.512 . . . . 0.0 111.372 -178.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -80.84 51.44 1.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.384 -178.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.18 144.42 31.52 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.159 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.29 148.06 93.9 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.725 2.283 . . . . 0.0 112.3 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.28 133.77 95.6 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.944 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.63 169.21 21.59 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.974 2.449 . . . . 0.0 112.201 178.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 23.4 p -99.96 166.83 10.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.448 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -62.89 -39.03 93.25 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.53 91.14 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.423 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.88 -44.53 96.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.884 177.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 42' ' ' THR . 98.6 mt -59.74 -44.25 93.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.849 178.351 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 43' ' ' GLN . 53.3 mt-10 -60.94 -40.21 92.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.008 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.403 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 7.9 m -64.82 -48.12 75.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.47 -177.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -62.8 -35.03 78.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.152 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.507 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -61.5 -53.26 58.79 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.83 -43.53 90.71 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 48' ' ' THR . 42.4 mt-10 -58.77 -46.62 87.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.883 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 55.4 tp -62.27 -31.85 72.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.213 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.6 mm-40 -79.98 -39.19 30.61 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.502 -178.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -84.29 -16.91 41.37 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 C--N 1.311 -1.09 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.695 -179.036 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.484 1.264 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.4 mp -106.34 106.4 20.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.994 0.426 . . . . 0.0 110.342 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.6 mm? -70.79 -32.67 69.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.41 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -51.37 -54.21 28.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.431 -175.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.89 -47.84 79.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.49 -179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.51 -49.53 74.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -69.11 -42.05 81.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.122 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.558 ' HA ' ' HE3' ' A' ' 8' ' ' MET . 1.2 tpt -63.74 -35.37 80.36 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.965 0.412 . . . . 0.0 110.816 -177.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -70.82 -43.66 68.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.129 178.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.42 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 6.3 tmtm? -70.72 -47.22 60.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.741 -176.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.42 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 80.3 m-85 -120.64 92.39 47.85 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.296 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -63.87 -27.56 67.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.463 2.109 . . . . 0.0 112.396 -178.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -94.27 12.75 25.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.424 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.88 122.35 33.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.192 0.52 . . . . 0.0 110.156 175.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -100.27 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.148 -176.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 9.2 p -84.07 39.96 0.73 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 122.003 0.906 . . . . 0.0 111.474 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.439 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 77.2 mtt180 -95.49 -72.59 0.62 Allowed 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.315 176.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.439 ' HD2' ' HB3' ' A' ' 17' ' ' ARG . 3.3 mptp? -114.66 -37.09 4.34 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.6 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.31 -44.15 88.45 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.825 0.822 . . . . 0.0 109.957 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.404 ' O ' ' HA ' ' A' ' 16' ' ' SER . 20.4 p90 -148.92 149.04 30.54 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 168.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -136.7 133.02 35.68 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.263 0.554 . . . . 0.0 110.958 -174.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.3 mt -94.85 153.92 17.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.116 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -135.22 154.21 51.66 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -178.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -75.24 123.74 25.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.542 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 11.7 t70 -87.35 -28.35 22.27 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.715 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.15 -43.56 1.69 Allowed Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 -173.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -100.31 10.67 40.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.977 0.894 . . . . 0.0 109.099 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.14 -160.55 30.53 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.779 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.508 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 19.3 m -130.92 121.51 25.31 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.542 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -125.74 -179.17 4.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.841 0.353 . . . . 0.0 110.924 -173.548 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.3 mt -84.04 118.99 32.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.144 0.497 . . . . 0.0 111.318 -175.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -90.14 -56.22 3.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.002 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -115.84 148.4 39.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.885 -178.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -150.44 111.39 4.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.267 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -120.05 7.38 10.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.044 0.45 . . . . 0.0 110.505 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.3 147.6 51.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -86.88 51.15 2.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.619 0.723 . . . . 0.0 109.983 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.32 146.33 57.51 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.302 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.45 136.61 77.06 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.865 2.377 . . . . 0.0 112.581 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.85 116.94 24.12 Favored Pre-proline 0 C--N 1.333 -0.138 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -60.47 151.0 78.09 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.672 2.248 . . . . 0.0 112.164 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.5 p -99.34 175.43 5.87 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.416 -178.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -53.79 -52.29 60.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.174 0.511 . . . . 0.0 110.759 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.63 -48.1 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -58.92 -49.94 75.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.459 HD23 HD11 ' A' ' 3' ' ' LEU . 80.2 mt -57.87 -49.11 77.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.207 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 42.4 mt-10 -69.15 -33.53 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.833 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -62.48 -41.9 99.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.682 0.277 . . . . 0.0 110.883 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -66.83 -35.2 79.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 110.257 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -66.66 -40.89 88.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.964 174.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.0 mt-10 -63.21 -43.9 96.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.264 177.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 39.0 mt-10 -62.33 -40.34 96.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.443 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 tp -65.94 -40.42 91.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.053 0.454 . . . . 0.0 110.454 176.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -66.0 -32.08 73.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.376 0.608 . . . . 0.0 110.615 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 46.5 tttm -100.06 14.23 31.35 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.856 -178.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 64.0 t30 . . . . . 0 C--N 1.324 -0.523 0 O-C-N 122.145 -0.347 . . . . 0.0 111.175 -177.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.6 mp -104.79 112.59 39.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.898 0.38 . . . . 0.0 110.434 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.519 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.6 mm? -70.41 -32.56 70.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.805 -178.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.501 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . 70.0 t80 -49.89 -52.42 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.74 -173.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.537 ' HB3' HD13 ' A' ' 53' ' ' LEU . 6.2 m-20 -66.76 -49.39 66.08 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.855 -177.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.23 -44.54 75.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.824 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 3' ' ' LEU . 73.2 mt -66.95 -48.83 78.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.694 -176.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.2 mtp -74.37 -22.26 59.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.161 -174.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -71.98 -37.81 69.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.093 0.473 . . . . 0.0 110.19 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -79.21 -48.92 13.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.993 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -116.14 101.17 53.94 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.914 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.41 -14.5 28.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.771 2.314 . . . . 0.0 112.369 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -94.13 4.97 53.15 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.219 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -100.69 117.73 35.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.757 0.313 . . . . 0.0 110.441 -177.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.543 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 45.3 t -95.77 129.29 46.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.832 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -68.15 139.49 56.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 17' ' ' ARG . 58.0 mtt-85 66.54 6.06 4.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.59 -177.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.543 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -109.95 -64.95 1.2 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.457 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 46.2 m-20 -93.08 -25.64 17.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.913 -176.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.495 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 44.9 p90 -147.91 131.82 17.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.427 177.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.823 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 31.2 tt0 -120.06 134.97 55.1 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.501 ' CD1' ' HB2' ' A' ' 4' ' ' TYR . 35.9 mt -95.79 153.67 17.62 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.656 -170.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.0 162.8 34.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.648 175.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 -100.16 135.4 41.65 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 120.835 0.35 . . . . 0.0 110.647 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.413 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 12.9 t70 -99.39 -42.01 7.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.289 0.566 . . . . 0.0 109.996 175.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.45 -63.22 0.16 Allowed Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 -178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -112.0 17.4 19.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.584 0.706 . . . . 0.0 110.104 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -170.52 163.87 37.09 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.873 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 16.3 m -115.92 116.17 27.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.413 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 19.8 p90 -113.55 -175.96 2.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.587 -175.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 mt -89.96 126.48 42.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.799 0.333 . . . . 0.0 111.649 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -104.9 -56.17 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 172.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.823 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 17.3 mmtm -85.91 104.27 15.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.928 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 28.9 t-105 -101.95 112.34 24.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 174.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.457 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 30.8 m-80 -116.39 17.24 15.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.288 -175.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.9 mt -106.67 149.62 27.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.395 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -89.46 35.93 0.83 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.293 0.568 . . . . 0.0 110.064 177.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -114.51 141.8 27.17 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.345 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -64.57 141.92 75.43 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 123.109 2.539 . . . . 0.0 111.852 175.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.445 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 4.0 mm? -66.75 138.37 95.34 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.583 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 40' ' ' LEU . 6.2 Cg_exo -77.39 -174.84 2.37 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.22 2.614 . . . . 0.0 112.248 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 82.1 p -105.04 170.86 7.63 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.442 -178.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.27 -48.08 81.49 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.144 0.278 . . . . 0.0 110.922 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.47 -44.09 72.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.04 -55.17 38.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.398 177.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.5 mt -56.41 -47.14 79.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.9 -29.54 67.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.089 -176.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 87.9 m -67.24 -44.2 80.02 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.376 178.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.428 ' CZ3' HD22 ' A' ' 46' ' ' LEU . 25.3 m0 -60.82 -45.17 95.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.157 0.503 . . . . 0.0 109.88 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.4 t-105 -59.27 -47.92 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.771 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.04 -41.46 95.19 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.167 -0.469 . . . . 0.0 112.243 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -60.12 -40.87 91.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.768 0.318 . . . . 0.0 110.713 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.537 HD13 ' HB3' ' A' ' 5' ' ' ASP . 9.9 tt -64.96 -42.19 94.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.778 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -69.01 -35.89 77.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.274 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -92.18 6.56 46.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.032 -175.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 54.3 t30 . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.824 178.273 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.1 mp -113.44 116.71 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.13 -32.35 73.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.926 0.393 . . . . 0.0 110.823 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -52.27 -48.42 65.3 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.1 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -61.63 -51.27 69.18 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.524 -178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.92 -46.35 88.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.569 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 84.4 mt -67.65 -46.26 83.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.966 -178.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.539 ' HE3' ' HA ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -66.03 -31.66 72.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.005 0.431 . . . . 0.0 110.694 -176.933 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.413 ' OH ' ' HB3' ' A' ' 52' ' ' GLU . 13.5 t80 -63.76 -51.64 63.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.112 177.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.4 tttp -81.75 -43.11 18.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.616 -174.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -123.03 94.08 47.61 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.937 0.398 . . . . 0.0 110.708 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.539 ' HA ' ' HE3' ' A' ' 8' ' ' MET . 61.2 Cg_endo -73.77 -18.11 22.34 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.675 2.25 . . . . 0.0 112.5 -177.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.39 1.73 43.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.295 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.434 ' HB2' ' CE1' ' A' ' 20' ' ' PHE . . . -87.26 143.47 27.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.1 0.476 . . . . 0.0 111.054 -179.099 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 98.7 t -127.32 123.14 61.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.449 177.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -88.96 37.43 0.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.713 0.768 . . . . 0.0 111.475 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -99.23 -55.86 2.57 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.596 170.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -105.47 -67.32 0.93 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.904 -168.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.506 ' HB3' HD22 ' A' ' 36' ' ' LEU . 3.9 m-20 -52.48 -39.69 61.48 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.54 -175.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.434 ' CE1' ' HB2' ' A' ' 14' ' ' ALA . 37.8 p90 -158.17 176.96 11.82 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 45.1 tt0 -152.47 148.8 27.84 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.931 0.396 . . . . 0.0 110.468 179.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 31' ' ' ILE . 17.2 mt -116.7 145.53 43.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.678 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.543 ' HD2' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mtt180 -141.99 148.44 38.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.256 0.551 . . . . 0.0 110.832 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -92.98 121.97 34.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.921 -175.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.75 -47.01 6.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.504 179.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.06 -35.25 1.86 Allowed Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -76.63 -25.56 53.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.921 0.867 . . . . 0.0 108.928 169.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 165.34 -175.09 41.19 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.251 -1.34 . . . . 0.0 111.549 -179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.5 m -108.35 108.97 20.17 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -121.66 -177.57 3.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.716 0.293 . . . . 0.0 111.315 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.414 ' HA ' HD23 ' A' ' 22' ' ' LEU . 13.2 mt -84.72 124.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.741 -175.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.543 ' HG2' ' HD2' ' A' ' 23' ' ' ARG . 0.6 OUTLIER -113.21 -18.92 11.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.849 0.357 . . . . 0.0 110.978 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.708 ' HZ1' ' HB2' ' A' ' 33' ' ' LYS . 3.8 ttmp? -126.38 140.81 52.21 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.0 t-105 -153.68 113.49 3.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.615 0.245 . . . . 0.0 110.624 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -117.79 -1.84 11.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.013 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.506 HD22 ' HB3' ' A' ' 19' ' ' ASP . 88.0 mt -73.91 152.12 40.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.659 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.9 mtt180 -85.88 45.99 1.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.943 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.43 139.75 30.49 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.369 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.12 145.52 67.2 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.411 2.074 . . . . 0.0 111.469 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 40' ' ' LEU . 4.2 mm? -65.7 127.38 93.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.782 -179.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.422 ' HG2' HD23 ' A' ' 46' ' ' LEU . 30.5 Cg_endo -63.68 164.55 20.88 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.875 2.383 . . . . 0.0 112.028 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 p -97.2 172.29 7.9 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.342 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.4 tp60 -50.43 -55.2 16.86 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.093 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.85 77.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.135 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.86 -44.8 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.449 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.422 HD23 ' HG2' ' A' ' 41' ' ' PRO . 92.6 mt -61.55 -43.72 98.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.972 0.415 . . . . 0.0 111.21 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.27 -29.02 64.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.294 -178.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.1 m -62.98 -44.59 95.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.655 177.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.7 m0 -68.17 -37.45 81.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.419 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.568 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 66.4 t-105 -60.89 -49.4 77.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.788 174.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -58.32 -41.8 85.35 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.489 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.413 ' HB3' ' OH ' ' A' ' 9' ' ' TYR . 79.7 mt-10 -62.35 -45.51 92.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.012 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.411 HD13 ' HB2' ' A' ' 9' ' ' TYR . 67.3 tp -60.14 -32.77 71.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.787 0.327 . . . . 0.0 111.052 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.4 mm-40 -81.26 -40.57 23.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.815 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -85.17 -17.88 35.84 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.341 0.591 . . . . 0.0 112.39 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 . . . . . 0 C--N 1.307 -1.262 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.826 -177.559 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.521 ' HE1' ' HB2' ' A' ' 50' ' ' TRP . 25.0 ttt . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.658 0.266 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.441 ' N ' HD13 ' A' ' 2' ' ' ILE . 4.1 mp -95.85 106.02 17.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.686 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.4 mm? -71.42 -32.77 68.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.33 -175.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.576 ' HE1' ' HG ' ' A' ' 16' ' ' SER . 87.0 t80 -51.35 -51.8 51.25 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.945 -174.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.85 -46.8 86.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.982 0.42 . . . . 0.0 111.065 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.76 -47.09 86.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.596 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.8 mt -65.83 -42.14 91.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.5 ' HE1' ' HA ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -63.81 -28.69 70.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.432 178.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -71.15 -36.62 72.12 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.963 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.61 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 85.1 tttt -86.85 -36.75 18.28 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.239 -179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -129.55 88.96 48.44 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.787 0.327 . . . . 0.0 111.054 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.5 ' HA ' ' HE1' ' A' ' 8' ' ' MET . 73.0 Cg_endo -77.24 -21.35 11.97 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.709 2.272 . . . . 0.0 113.146 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.56 5.99 45.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.428 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.22 147.1 23.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.522 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 38.9 t -95.32 128.29 46.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.019 0.438 . . . . 0.0 111.058 -176.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.576 ' HG ' ' HE1' ' A' ' 4' ' ' TYR . 6.6 m -61.68 138.54 58.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.812 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.51 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 0.7 OUTLIER 69.95 -3.82 1.64 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.571 0.748 . . . . 0.0 111.92 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.522 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 61.6 tttp -112.17 -61.12 1.76 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.777 0.322 . . . . 0.0 110.426 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.422 ' HB3' HD22 ' A' ' 36' ' ' LEU . 28.6 m-20 -85.91 -37.17 19.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.379 0.609 . . . . 0.0 109.974 177.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -134.07 114.42 13.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.947 173.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 43.7 tt0 -96.54 141.56 29.68 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.488 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.425 HD12 ' CD1' ' A' ' 4' ' ' TYR . 44.1 mt -107.59 153.3 23.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.097 0.475 . . . . 0.0 111.589 -172.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.579 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 29.7 ttt180 -132.65 122.35 24.54 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.826 174.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.418 ' HA ' ' HA ' ' A' ' 29' ' ' SER . 47.5 t30 -97.19 116.02 28.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.186 0.517 . . . . 0.0 110.675 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -95.56 -11.62 27.05 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.557 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.52 -47.26 1.07 Allowed Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 -174.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -71.49 -17.39 62.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.732 0.777 . . . . 0.0 109.794 174.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 164.95 161.75 14.56 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.999 178.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 24' ' ' ASN . 19.7 m -99.76 108.72 21.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.686 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 43.0 p90 -111.71 -168.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.685 0.279 . . . . 0.0 111.117 -176.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -76.54 122.99 32.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.087 0.47 . . . . 0.0 111.833 -174.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.579 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 9.2 tp10 -96.06 -61.67 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.157 172.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.647 ' HB2' ' HZ2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -119.98 119.04 32.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.115 -176.526 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -99.55 111.07 23.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -115.51 11.32 15.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.49 0.662 . . . . 0.0 110.1 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' A' ' 19' ' ' ASP . 84.2 mt -89.73 140.03 29.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -82.65 44.93 0.93 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.476 0.655 . . . . 0.0 110.351 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.05 147.3 65.29 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.417 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -55.5 145.15 70.39 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 123.016 2.477 . . . . 0.0 112.654 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.74 125.02 85.43 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.155 177.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -58.58 147.35 87.28 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.912 2.408 . . . . 0.0 113.087 -178.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.409 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.7 p -83.49 157.98 22.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.208 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.482 HE21 ' HG3' ' A' ' 47' ' ' GLU . 16.8 tp60 -57.43 -42.85 83.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.12 0.486 . . . . 0.0 110.296 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.49 -51.85 66.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.412 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.69 -42.45 98.01 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.662 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.453 HD22 HD11 ' A' ' 3' ' ' LEU . 90.5 mt -54.26 -53.52 52.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.198 177.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.482 ' HG3' HE21 ' A' ' 43' ' ' GLN . 46.4 mt-10 -71.22 -18.99 62.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.627 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 95.0 m -70.97 -46.69 61.9 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 174.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.61 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.7 m0 -61.5 -40.72 95.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.995 0.426 . . . . 0.0 109.876 177.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.521 ' HB2' ' HE1' ' A' ' 1' ' ' MET . 75.1 t-105 -60.11 -44.38 94.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.376 176.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -60.53 -49.48 77.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.457 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -63.68 -35.69 81.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.727 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.99 -45.7 87.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.643 175.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -69.75 -27.97 65.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.024 0.44 . . . . 0.0 111.185 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -84.4 1.28 46.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.1 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.5 t30 . . . . . 0 N--CA 1.466 0.337 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.012 -179.776 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 120.576 0.227 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 30.4 mm -88.57 107.06 17.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 110.331 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.712 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.1 mm? -70.13 -35.57 74.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.873 0.368 . . . . 0.0 110.789 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.479 ' HB2' HD12 ' A' ' 22' ' ' LEU . 71.3 t80 -52.46 -50.65 62.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.924 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.462 ' OD1' HD11 ' A' ' 53' ' ' LEU . 0.7 OUTLIER -65.83 -38.36 88.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -174.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.54 -44.29 78.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.018 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 3' ' ' LEU . 87.9 mt -61.65 -49.21 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.427 179.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -69.56 -22.73 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.84 -177.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -67.66 -41.98 82.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -92.01 -40.11 11.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.255 -178.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -119.26 97.05 50.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.097 -176.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -74.61 -13.66 22.3 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.555 2.17 . . . . 0.0 111.419 175.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -87.4 2.2 51.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.414 ' HB2' ' CE1' ' A' ' 20' ' ' PHE . . . -87.3 105.35 17.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.958 0.409 . . . . 0.0 110.815 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.1 t -81.9 117.74 28.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.774 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m -69.36 149.87 47.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.578 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 64.83 22.41 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.525 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -146.06 -72.36 0.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.084 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.539 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 4.4 m-20 -80.41 -17.42 51.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.356 0.598 . . . . 0.0 110.429 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 14' ' ' ALA . 40.3 p90 -160.07 144.81 14.79 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.092 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -118.91 131.21 56.04 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.729 0.3 . . . . 0.0 110.196 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.479 HD12 ' HB2' ' A' ' 4' ' ' TYR . 29.0 mt -102.77 153.35 20.25 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.436 ' O ' ' HA ' ' A' ' 29' ' ' SER . 4.1 mtt180 -137.4 148.24 46.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.675 174.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -89.33 126.88 35.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.222 -174.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.72 -13.07 16.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.54 -33.72 6.15 Favored Glycine 0 N--CA 1.453 -0.216 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -172.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -87.93 2.45 51.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.07 0.938 . . . . 0.0 109.1 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 130.86 176.12 14.29 Favored Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.449 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 19.3 m -104.69 122.5 45.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.767 0.317 . . . . 0.0 110.269 177.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.712 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 2.9 p90 -120.61 -179.75 4.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.353 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.83 120.68 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.416 -173.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -94.09 -58.33 2.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.165 0.507 . . . . 0.0 109.707 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -115.67 145.88 42.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.973 -178.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.2 t-105 -128.02 111.93 14.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.114 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -113.7 -2.83 13.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 -179.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.539 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 34.7 mt -66.02 140.75 58.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -84.85 39.53 0.76 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.683 0.754 . . . . 0.0 110.197 178.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -123.36 154.71 65.81 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.961 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -69.48 151.41 70.69 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.082 1.855 . . . . 0.0 112.222 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.24 116.66 49.24 Favored Pre-proline 0 N--CA 1.45 -0.467 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.17 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -65.32 159.58 46.61 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.513 2.142 . . . . 0.0 112.224 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.2 p -92.29 167.58 11.91 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.45 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -55.5 -45.98 77.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.154 0.502 . . . . 0.0 110.005 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.84 91.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.178 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.3 -43.68 96.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.075 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.5 mt -60.17 -46.93 88.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.181 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -68.89 -24.44 64.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.338 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.9 m -63.68 -50.8 67.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.814 0.34 . . . . 0.0 110.779 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 8.8 m0 -70.46 -32.16 69.6 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.181 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -64.93 -41.85 95.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.783 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.38 -51.08 71.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.194 175.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -63.96 -30.84 71.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.071 0.462 . . . . 0.0 111.231 -178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.462 HD11 ' OD1' ' A' ' 5' ' ' ASP . 6.6 tt -65.93 -38.25 88.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.154 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.74 -32.58 20.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.552 -178.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.99 -15.62 58.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.379 0.609 . . . . 0.0 110.578 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.9 t30 . . . . . 0 C--N 1.315 -0.911 0 CA-C-N 115.013 -0.994 . . . . 0.0 108.854 171.337 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 2' ' ' ILE . 4.1 mp -74.0 106.35 3.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.484 ' O ' HG13 ' A' ' 7' ' ' ILE . 2.5 mm? -64.49 -34.96 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.731 -173.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -51.23 -47.02 62.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.479 -175.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -68.87 -51.23 42.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.986 0.422 . . . . 0.0 110.884 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.1 -45.74 83.16 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.058 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.8 mt -65.69 -41.91 91.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -177.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 61.0 mtp -72.84 -19.14 61.37 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.101 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -74.65 -33.58 62.55 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 173.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -75.97 -54.45 6.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.679 178.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -120.69 91.95 47.58 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -63.43 -24.37 71.0 Favored 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.733 2.289 . . . . 0.0 112.817 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -93.76 10.67 32.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.809 0.338 . . . . 0.0 111.634 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -92.43 127.75 38.04 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.1 t -96.7 117.58 41.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-O 121.019 0.438 . . . . 0.0 111.192 -176.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -67.19 142.44 56.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 67.23 22.6 9.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.651 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -140.68 -69.41 0.39 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.065 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -93.35 -34.96 13.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.363 0.601 . . . . 0.0 109.609 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -130.47 132.27 45.58 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 170.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.598 ' HB2' ' HB3' ' A' ' 33' ' ' LYS . 49.0 mt-10 -114.19 127.8 56.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 121.265 0.555 . . . . 0.0 111.013 -175.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.454 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 25.5 mt -109.43 149.71 29.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.432 178.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.514 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mpt_? -130.7 164.66 24.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.903 0.382 . . . . 0.0 110.756 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -82.7 125.0 30.74 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.938 -174.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.416 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 15.8 t70 -91.1 -52.3 4.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.423 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 154.09 -35.32 0.72 Allowed Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.206 -176.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -121.4 34.45 5.19 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.83 179.78 17.11 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.788 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.8 m -113.21 137.53 51.33 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.416 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 21.7 p90 -121.6 175.57 6.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.727 0.299 . . . . 0.0 111.029 -176.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.471 HG13 ' HG ' ' A' ' 3' ' ' LEU . 39.9 mt -81.74 122.46 36.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.91 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.514 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -116.84 -33.05 4.91 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.569 175.324 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.598 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -124.18 133.08 53.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.55 0.214 . . . . 0.0 110.428 -179.019 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -134.34 109.49 8.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -108.25 -1.56 20.05 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.913 0.387 . . . . 0.0 110.711 -176.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.19 143.87 56.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.672 175.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -90.25 34.34 0.87 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.475 0.655 . . . . 0.0 109.949 -179.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -125.02 144.65 47.78 Favored Pre-proline 0 C--N 1.316 -0.888 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.739 -178.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -61.0 150.88 81.97 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.688 2.259 . . . . 0.0 112.287 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -66.41 139.76 96.35 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.656 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.97 166.12 19.45 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.846 2.364 . . . . 0.0 112.608 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.471 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 77.8 p -89.02 158.0 18.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.203 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -57.29 -43.58 83.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.281 0.562 . . . . 0.0 109.749 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.38 76.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.742 -1.117 . . . . 0.0 111.584 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.39 -41.35 96.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.745 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 42' ' ' THR . 95.8 mt -51.39 -50.0 60.45 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 111.132 176.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -62.23 -41.83 98.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.735 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.8 m -65.31 -34.69 78.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.378 -177.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -59.97 -45.86 91.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.022 0.439 . . . . 0.0 109.843 175.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 -62.45 -40.57 97.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.265 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.49 -50.29 73.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.069 177.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.06 -43.43 98.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.214 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.97 -36.0 82.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.508 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -34.35 33.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.243 -178.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -86.94 -11.05 51.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 . . . . . 0 C--N 1.315 -0.909 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.326 178.692 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.408 HG21 ' H ' ' A' ' 4' ' ' TYR . 3.8 mp -117.72 132.4 67.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.809 -179.156 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.407 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.9 mm? -59.66 -34.47 72.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.919 0.39 . . . . 0.0 111.579 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.408 ' H ' HG21 ' A' ' 2' ' ' ILE . 62.0 t80 -52.95 -53.24 52.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -60.86 -48.16 83.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.264 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.34 -51.0 71.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.614 -178.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 3' ' ' LEU . 75.8 mt -62.39 -42.74 96.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.763 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -24.96 65.51 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.882 -176.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -72.21 -45.22 61.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.878 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.698 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 46.1 tttp -72.94 -49.86 26.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.66 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -115.62 94.8 41.56 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.888 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -67.54 -17.57 48.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.832 2.354 . . . . 0.0 111.814 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -95.85 9.51 40.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.909 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.856 ' HB1' ' HZ ' ' A' ' 20' ' ' PHE . . . -82.01 140.72 33.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.125 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.493 ' C ' ' H ' ' A' ' 17' ' ' ARG . 43.4 t -107.45 87.15 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.167 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 m -83.48 37.81 0.59 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 122.324 1.059 . . . . 0.0 109.581 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.493 ' H ' ' C ' ' A' ' 15' ' ' VAL . 51.9 mtt180 -96.07 -53.96 3.47 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 113.517 -1.674 . . . . 0.0 111.137 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -145.05 -45.78 0.23 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.152 -163.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -61.94 -27.7 69.01 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.723 0.773 . . . . 0.0 109.514 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.856 ' HZ ' ' HB1' ' A' ' 14' ' ' ALA . 35.4 p90 -155.89 149.04 24.48 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.374 167.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -145.04 146.11 31.74 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.301 -170.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 39.0 mt -97.34 151.93 19.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.483 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.3 mpt_? -136.75 168.4 19.6 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.227 175.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -87.58 126.01 34.69 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.454 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 19.9 t70 -102.22 -15.53 16.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.299 0.571 . . . . 0.0 109.99 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.43 -53.34 0.8 Allowed Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.64 10.25 21.26 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.302 0.572 . . . . 0.0 109.924 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 144.18 -170.76 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.234 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.42 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 40.2 m -102.1 123.84 46.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.829 0.347 . . . . 0.0 110.607 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.454 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.2 p90 -122.7 177.81 5.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.355 -176.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.4 mt -75.38 121.05 26.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.226 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.483 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 26.3 tt0 -122.21 -46.08 2.2 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.987 177.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -89.82 131.55 35.71 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -151.2 110.72 3.99 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -175.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -107.11 1.86 24.49 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.525 -175.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.7 mt -91.65 145.93 24.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.453 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 37' ' ' ARG . 58.5 mtt180 -83.22 48.02 1.33 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.757 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.97 145.86 55.48 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.49 -178.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.93 145.16 61.04 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.344 2.03 . . . . 0.0 111.305 174.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.89 134.02 95.93 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.596 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.79 158.95 22.45 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.487 2.791 . . . . 0.0 112.924 -178.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.434 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 59.9 p -88.64 158.68 18.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.078 -175.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -53.64 -44.77 69.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.242 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.11 -51.89 67.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.59 -43.43 96.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.484 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.2 mt -53.93 -47.41 71.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.896 0.379 . . . . 0.0 111.231 178.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -72.53 -29.25 63.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.483 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.9 m -69.33 -41.22 76.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.871 176.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.698 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 37.9 m0 -60.08 -46.09 90.73 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 174.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -57.82 -48.74 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.593 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -56.84 -53.27 59.78 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.563 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -65.72 -30.36 71.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.442 -177.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.0 -38.79 89.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.909 0.385 . . . . 0.0 110.294 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.3 -30.9 38.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.161 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 45.4 tttt -79.46 -15.5 57.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.682 -178.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.0 t30 . . . . . 0 C--N 1.315 -0.933 0 N-CA-C 108.525 -0.916 . . . . 0.0 108.525 173.098 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.405 ' N ' HD13 ' A' ' 2' ' ' ILE . 4.3 mp -97.51 112.7 30.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.206 0.527 . . . . 0.0 110.446 -178.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.489 HD11 HD13 ' A' ' 46' ' ' LEU . 2.4 mm? -65.71 -33.35 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.035 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -52.37 -54.18 35.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.907 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.91 -44.67 96.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.337 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.68 -51.41 69.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.421 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 3' ' ' LEU . 71.5 mt -64.56 -41.62 92.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.607 0.241 . . . . 0.0 110.745 -178.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.485 ' HE1' ' HA ' ' A' ' 8' ' ' MET . 0.1 OUTLIER -69.59 -13.95 62.59 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.584 -179.303 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -82.19 -40.24 22.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -76.99 -51.75 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.741 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -118.14 98.17 51.26 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.137 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.15 -31.33 54.54 Favored 'Trans proline' 0 CA--C 1.528 0.211 0 C-N-CA 123.032 2.488 . . . . 0.0 113.123 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -102.61 19.49 18.97 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -176.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.88 119.53 24.52 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.52 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.444 ' C ' ' H ' ' A' ' 17' ' ' ARG . 47.5 t -84.7 88.55 2.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.548 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.467 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 9.9 p -85.89 36.73 0.68 Allowed 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.459 1.123 . . . . 0.0 110.24 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.444 ' H ' ' C ' ' A' ' 15' ' ' VAL . 93.8 mtt180 -97.29 -60.34 1.6 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 113.629 -1.623 . . . . 0.0 110.988 175.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.5 tttp -128.89 -43.09 1.37 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 111.655 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.614 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 5.6 t70 -65.26 -34.74 79.07 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 16' ' ' SER . 14.1 p90 -143.44 132.08 22.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 164.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -105.13 141.72 36.18 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.744 -169.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.5 mt -113.49 152.71 29.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.687 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -144.91 174.57 10.9 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.126 0.488 . . . . 0.0 109.828 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -129.99 117.53 20.21 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.763 -176.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.92 -27.18 57.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.297 0.57 . . . . 0.0 109.703 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.54 -42.37 1.17 Allowed Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.637 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -99.47 -0.07 41.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.443 0.639 . . . . 0.0 110.644 -176.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 177.22 155.99 14.97 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.226 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.8 m -105.05 122.16 45.29 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -130.84 -179.3 5.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.983 -173.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.3 mt -87.36 132.81 31.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.565 ' HG3' ' HD2' ' A' ' 33' ' ' LYS . 13.1 pt-20 -111.63 -34.01 6.19 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.24 176.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.565 ' HD2' ' HG3' ' A' ' 32' ' ' GLU . 10.1 mptt -126.02 148.71 49.23 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 175.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -144.04 111.61 6.03 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.614 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 90.1 m-20 -123.06 13.66 9.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.704 0.288 . . . . 0.0 110.643 -178.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.0 mt -66.22 153.45 42.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.183 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 37' ' ' ARG . 62.2 mtt180 -82.13 42.35 0.73 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.127 178.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -152.4 154.58 32.16 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.484 -177.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.94 171.1 17.31 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.327 2.018 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -79.51 135.63 56.7 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.794 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.63 173.51 12.45 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.724 2.282 . . . . 0.0 111.819 176.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.603 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 34.2 p -99.11 161.4 13.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.073 -177.306 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.66 -44.76 85.93 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.07 -45.86 89.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.363 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.51 -45.01 95.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.656 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.6 mt -50.89 -50.47 57.13 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.494 0.496 . . . . 0.0 111.476 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -71.28 -28.62 64.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -178.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.9 m -66.03 -38.9 89.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.88 0.371 . . . . 0.0 110.31 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -63.17 -42.98 99.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -61.89 -44.73 96.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.373 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -61.09 -46.98 88.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.427 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -66.98 -28.7 68.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.281 . . . . 0.0 111.372 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.86 -54.8 21.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.842 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.99 -32.41 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.555 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -95.85 27.61 3.46 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 32.4 p30 . . . . . 0 N--CA 1.469 0.525 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.425 -177.812 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.5 mmm . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.649 0.261 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.7 mm -87.53 110.76 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 2.3 mm? -69.22 -38.06 78.35 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.488 -175.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -54.73 -48.69 72.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.525 -176.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.4 -49.88 76.12 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.213 0.321 . . . . 0.0 111.016 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.88 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.587 -178.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.45 -43.55 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.481 ' HA ' ' HE3' ' A' ' 8' ' ' MET . 0.0 OUTLIER -66.84 -23.13 66.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.855 -177.13 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -77.09 -48.61 17.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.194 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.93 -27.72 23.18 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.73 0.3 . . . . 0.0 110.649 -177.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -116.16 83.62 12.83 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -67.15 -28.46 40.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.904 2.403 . . . . 0.0 113.211 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -111.26 27.14 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.659 -174.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.65 141.91 34.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.64 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.524 ' HB ' ' HB2' ' A' ' 19' ' ' ASP . 41.6 t -81.02 103.72 8.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.063 0.458 . . . . 0.0 111.144 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.0 m -69.82 140.29 53.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.234 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.1 mtt-85 71.12 11.96 6.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.556 173.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -140.4 -59.66 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.796 0.331 . . . . 0.0 110.452 173.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.524 ' HB2' ' HB ' ' A' ' 15' ' ' VAL . 0.5 OUTLIER -76.39 -26.31 55.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.265 0.555 . . . . 0.0 110.024 176.955 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -142.25 114.4 8.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 166.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -94.14 136.12 34.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.582 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.3 mt -105.86 152.79 22.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.626 -175.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.826 HH11 ' HG2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -139.74 155.51 47.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.366 174.236 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -88.35 109.6 20.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.882 -178.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.527 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 28.1 t70 -84.82 -42.84 14.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.08 0.467 . . . . 0.0 111.205 -178.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.37 -39.09 0.93 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.675 -177.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -107.19 27.84 8.65 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.62 179.52 15.81 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.124 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 m -90.99 131.31 36.67 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.557 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 1.7 p90 -125.94 -177.95 4.12 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.0 mt -74.67 121.54 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.091 0.472 . . . . 0.0 111.449 -175.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.826 ' HG2' HH11 ' A' ' 23' ' ' ARG . 3.7 tp10 -100.22 -52.66 3.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 176.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -129.56 111.36 12.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.557 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -100.89 112.41 24.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 -177.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.444 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 80.6 m-20 -114.63 -6.12 12.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.621 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 36.5 mt -65.54 137.73 57.59 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.482 0.658 . . . . 0.0 111.278 -178.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -83.27 36.18 0.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.926 0.87 . . . . 0.0 109.901 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 36' ' ' LEU . . . -125.08 147.48 57.15 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.458 -1.247 . . . . 0.0 109.751 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.08 144.61 94.6 Favored 'Trans proline' 0 C--O 1.238 0.525 0 C-N-CA 123.023 2.482 . . . . 0.0 113.011 178.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.31 126.86 92.79 Favored Pre-proline 0 N--CA 1.45 -0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.33 176.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.69 150.83 59.29 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.019 2.479 . . . . 0.0 112.564 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 p -102.72 168.6 9.14 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.896 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -56.59 -54.57 44.48 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.938 -178.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.98 85.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.027 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.574 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 34.0 mt-10 -57.44 -54.34 47.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.982 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.5 mt -51.68 -49.39 62.48 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.585 -178.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.19 -31.86 68.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.649 -177.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.2 m -67.36 -44.33 79.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.901 178.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.574 ' CZ2' ' HB3' ' A' ' 45' ' ' GLU . 15.5 m0 -64.18 -39.49 94.12 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.58 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -60.31 -49.14 78.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.173 176.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -62.36 -43.89 97.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.717 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.98 -36.55 83.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.239 -0.184 . . . . 0.0 110.742 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -64.18 -39.91 94.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.806 0.336 . . . . 0.0 110.504 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.58 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 26.9 mm-40 -66.9 -37.18 83.89 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.424 0.631 . . . . 0.0 109.963 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -86.97 5.63 36.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.043 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.7 t30 . . . . . 0 C--N 1.323 -0.547 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.19 -176.048 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.6 0.238 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 59.2 mt -119.39 128.76 75.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.482 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.8 mm? -67.19 -37.58 83.92 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.248 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -52.44 -46.61 66.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.471 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.65 -47.31 85.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.828 0.347 . . . . 0.0 111.12 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.4 95.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.397 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.7 mt -63.37 -40.74 90.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.63 179.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.581 ' HE1' ' HA ' ' A' ' 8' ' ' MET . 28.9 mmt -68.46 -21.93 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.74 0.305 . . . . 0.0 111.313 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -74.67 -43.44 55.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 0.0 110.541 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -90.81 -35.33 14.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.687 -175.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -121.6 84.55 42.81 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.542 0.21 . . . . 0.0 111.253 -176.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -70.9 -22.9 26.25 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.895 2.397 . . . . 0.0 112.782 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -95.94 8.36 43.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.452 -176.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.99 139.89 31.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.2 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 t -106.16 127.6 61.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 CA-C-O 121.118 0.485 . . . . 0.0 111.108 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.7 p -73.09 152.67 41.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.034 176.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.1 mtm180 65.25 17.04 10.86 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.208 0.527 . . . . 0.0 109.96 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -141.58 -73.73 0.32 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.468 -174.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -80.34 -29.71 38.0 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.453 0.644 . . . . 0.0 109.857 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -139.93 136.18 33.58 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.918 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.676 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 5.8 tp10 -96.61 127.24 42.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.273 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.7 mt -100.69 153.46 19.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.977 0.417 . . . . 0.0 110.126 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -129.71 142.2 50.75 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -94.73 109.99 21.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.114 0.483 . . . . 0.0 110.878 -176.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -79.02 -39.2 34.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.399 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.19 -42.22 1.64 Allowed Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -173.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -89.13 -5.89 57.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.856 0.836 . . . . 0.0 109.024 173.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 167.93 -177.89 41.98 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.44 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 21.3 m -120.34 130.59 54.49 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.4 p90 -124.4 -179.77 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.248 0.343 . . . . 0.0 111.231 -176.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.7 mt -84.85 121.41 36.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.365 0.602 . . . . 0.0 111.466 -173.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -96.9 -58.29 2.07 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.296 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.676 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 9.7 ttmm -113.58 138.67 49.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.206 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -125.83 112.16 15.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -116.31 11.03 14.93 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.901 0.381 . . . . 0.0 111.41 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 66.6 mt -87.69 144.29 26.73 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.901 0.382 . . . . 0.0 111.124 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -81.5 62.88 5.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.43 0.633 . . . . 0.0 109.811 174.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.22 143.65 19.69 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.577 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.31 146.89 93.34 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.578 2.185 . . . . 0.0 111.817 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.82 118.91 62.46 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.342 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.18 146.02 97.22 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.692 2.262 . . . . 0.0 112.548 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.434 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 9.2 p -93.82 171.75 8.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.738 -177.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.517 HE21 ' HG3' ' A' ' 47' ' ' GLU . 21.6 tp60 -53.78 -51.69 62.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.694 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.08 -42.56 76.89 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.276 178.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -50.02 72.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.957 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.9 mt -58.05 -44.48 87.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.682 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.517 ' HG3' HE21 ' A' ' 43' ' ' GLN . 42.6 mt-10 -65.13 -44.06 89.88 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.103 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -59.06 -43.67 91.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -61.28 -40.74 95.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.355 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.0 t-105 -66.29 -44.08 84.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.123 177.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 64.5 mt-10 -61.28 -42.4 98.59 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.887 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.34 -30.81 62.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.767 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.4 tp -77.57 -40.01 43.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.01 0.433 . . . . 0.0 111.025 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -83.47 -23.22 32.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -86.99 -16.02 36.98 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.361 0.6 . . . . 0.0 110.385 176.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -133.27 99.43 14.68 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.309 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.05 126.93 19.01 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.275 1.984 . . . . 0.0 111.306 178.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -57.87 149.54 68.99 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.614 2.209 . . . . 0.0 111.572 178.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -81.31 87.58 6.13 Favored 'General case' 0 C--N 1.321 -0.63 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 . . . . . 0 C--N 1.316 -0.864 0 CA-C-N 114.432 -1.258 . . . . 0.0 110.495 -179.244 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.41 ' SD ' ' HG2' ' A' ' 47' ' ' GLU . 18.0 ptt? . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.054 0.454 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.67 125.76 73.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.482 HD11 HD13 ' A' ' 46' ' ' LEU . 4.0 mm? -61.04 -40.29 93.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.7 -176.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.51 ' HB2' HD13 ' A' ' 22' ' ' LEU . 15.1 t80 -55.2 -51.68 65.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.222 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -60.76 -46.86 88.83 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.369 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.85 84.15 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.337 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.457 HD13 HD13 ' A' ' 31' ' ' ILE . 70.3 mt -67.27 -45.55 85.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 -179.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.527 ' HA ' ' HE3' ' A' ' 8' ' ' MET . 2.2 mmt -65.96 -27.83 68.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.618 -176.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -75.95 -42.21 49.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.028 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.546 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 9.4 tmtt? -84.49 -36.57 22.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.827 -176.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.546 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 92.4 m-85 -127.62 88.23 54.08 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.008 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.84 -20.53 17.16 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.684 2.256 . . . . 0.0 112.266 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -86.24 5.59 33.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.892 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.65 129.67 37.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.2 t -90.37 110.28 21.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.35 0.595 . . . . 0.0 111.405 -175.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.407 ' HB3' ' CZ ' ' A' ' 20' ' ' PHE . 22.1 p -79.85 162.06 25.26 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 63.57 23.04 13.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.595 0.712 . . . . 0.0 110.116 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -145.89 -68.21 0.28 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.788 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.569 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 27.2 m-20 -88.93 -52.78 4.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.392 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.649 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 41.3 p90 -117.62 130.2 56.23 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.315 0.578 . . . . 0.0 111.411 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.757 ' HB2' ' HB2' ' A' ' 33' ' ' LYS . 2.0 mp0 -129.6 161.69 29.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.228 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.51 HD13 ' HB2' ' A' ' 4' ' ' TYR . 46.5 mt -96.57 154.38 17.31 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.621 0.724 . . . . 0.0 111.971 -173.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.565 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 1.8 tpt180 -134.24 156.37 48.52 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -89.89 120.68 31.32 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.515 -0.474 . . . . 0.0 111.115 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.598 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 23.3 t70 -92.27 -23.93 19.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.923 177.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.8 -47.97 0.99 Allowed Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.201 -175.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.585 0.707 . . . . 0.0 109.869 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 169.43 -179.87 41.71 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.596 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 m -98.29 119.27 36.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.598 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 24.6 p90 -110.04 -179.44 3.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.842 0.353 . . . . 0.0 111.034 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.457 HD13 HD13 ' A' ' 7' ' ' ILE . 35.3 mt -91.03 123.01 43.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.797 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.565 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 2.1 tm-20 -119.93 -52.99 2.19 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.757 ' HB2' ' HB2' ' A' ' 21' ' ' GLU . 2.7 mmmp? -78.6 113.67 16.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.634 173.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -134.76 110.34 9.15 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.569 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 2.1 m-20 -118.91 4.17 11.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.196 -178.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.3 mt -73.78 141.23 46.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.072 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -79.96 46.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.341 0.591 . . . . 0.0 110.803 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.48 145.82 30.28 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.881 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.24 155.21 51.72 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.653 2.235 . . . . 0.0 112.441 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 40' ' ' LEU . 4.0 mm? -71.66 137.08 83.02 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.161 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.487 ' HG2' HD21 ' A' ' 46' ' ' LEU . 74.4 Cg_endo -76.25 -177.91 4.03 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.078 2.518 . . . . 0.0 112.098 175.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.445 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 40.5 p -98.64 164.82 12.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.935 -177.041 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -60.44 -46.03 91.51 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 110.038 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.43 -48.09 74.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -56.95 -51.22 70.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.257 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.487 HD21 ' HG2' ' A' ' 41' ' ' PRO . 68.2 mt -54.88 -50.82 67.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.438 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 48.2 mt-10 -66.75 -33.35 75.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.509 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.9 m -65.87 -37.9 87.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.539 0.209 . . . . 0.0 110.705 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.463 ' CE2' ' HG3' ' A' ' 10' ' ' LYS . 22.1 m0 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.715 0.293 . . . . 0.0 110.244 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -60.92 -44.55 97.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.205 0.526 . . . . 0.0 110.03 173.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.9 mt-10 -61.38 -46.66 89.28 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.14 177.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.51 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 51.7 mt-10 -63.33 -42.28 98.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.855 178.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.1 tp -57.87 -43.94 86.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.916 0.389 . . . . 0.0 111.191 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -75.56 -33.12 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.908 -174.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.401 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 48.0 tttm -84.59 -7.48 59.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.04 0.448 . . . . 0.0 111.577 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 5.0 t30 -96.14 142.82 25.1 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.768 -174.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -59.66 165.37 9.87 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.137 2.558 . . . . 0.0 111.994 172.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -68.88 174.21 9.06 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.621 2.214 . . . . 0.0 112.162 178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -71.03 102.74 2.51 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.921 -175.771 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.483 1.218 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.41 HD11 ' N ' ' A' ' 2' ' ' ILE . 4.3 mp -78.87 104.42 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.484 0.659 . . . . 0.0 110.434 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.54 ' HB2' ' O ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -71.12 -31.92 68.36 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.265 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -51.04 -53.89 29.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.378 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.418 ' HB3' HD22 ' A' ' 53' ' ' LEU . 1.8 m-20 -64.52 -42.4 95.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.472 -178.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.414 ' HB3' ' HB3' ' A' ' 49' ' ' TRP . . . -59.87 -44.22 94.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.724 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.504 HG13 ' O ' ' A' ' 3' ' ' LEU . 83.5 mt -61.84 -42.17 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.579 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.592 ' HE2' ' HA ' ' A' ' 8' ' ' MET . 23.4 mmt -66.34 -22.88 66.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.957 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -71.93 -45.99 59.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -87.75 -42.45 12.6 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.282 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -117.84 86.96 25.93 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 116.66 -0.245 . . . . 0.0 110.788 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.64 -26.84 22.99 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.742 2.295 . . . . 0.0 112.825 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -91.33 12.13 21.44 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.457 ' O ' ' HE3' ' A' ' 8' ' ' MET . . . -95.83 132.71 40.81 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 176.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.0 t -101.56 127.15 55.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.9 m -67.22 141.85 57.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.044 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ttm-85 61.79 22.77 13.26 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.917 0.887 . . . . 0.0 111.225 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -135.0 -62.21 0.73 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.264 172.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.448 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 47.0 m-20 -89.93 -27.68 19.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.051 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -152.06 144.36 24.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.807 177.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.448 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 39.8 tt0 -126.6 136.17 52.19 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 mt -89.83 154.08 20.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.939 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.3 tpp180 -136.45 153.35 51.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.582 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -87.07 112.39 21.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.895 0.378 . . . . 0.0 110.354 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.524 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 19.4 t70 -82.51 -21.07 35.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.488 0.661 . . . . 0.0 110.262 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.12 -41.06 2.34 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -170.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -78.59 -6.46 55.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.062 -0.569 . . . . 0.0 110.444 173.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 143.07 -171.79 24.82 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.132 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.54 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.0 m -95.73 111.25 23.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.524 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -123.9 -176.39 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.905 -177.068 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.8 mt -81.12 131.56 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.863 0.363 . . . . 0.0 111.158 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -125.63 -58.95 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.572 173.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 7.5 tmtm? -87.65 125.97 34.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.389 -175.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -134.9 115.74 13.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.653 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -112.59 1.2 15.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.747 -176.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.448 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 77.7 mt -90.77 154.75 19.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -175.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -85.94 43.21 1.03 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -119.84 143.07 34.34 Favored Pre-proline 0 C--N 1.315 -0.897 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.226 -175.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.48 142.49 72.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.485 2.123 . . . . 0.0 112.283 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.407 HD11 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -76.35 125.31 87.81 Favored Pre-proline 0 N--CA 1.447 -0.609 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.521 ' HG3' ' CH2' ' A' ' 49' ' ' TRP . 33.9 Cg_endo -63.92 158.56 46.59 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 123.143 2.562 . . . . 0.0 112.386 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.419 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 60.5 p -81.62 169.73 16.69 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.454 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -60.34 -43.77 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.65 71.48 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -61.38 -45.25 95.16 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.768 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.477 HD23 HD11 ' A' ' 3' ' ' LEU . 88.1 mt -52.79 -48.8 66.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.594 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.21 -30.36 68.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.776 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.4 m -66.54 -38.14 86.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.417 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.521 ' CH2' ' HG3' ' A' ' 41' ' ' PRO . 46.4 m0 -56.42 -51.39 68.57 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.059 0.457 . . . . 0.0 109.855 175.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -59.21 -46.63 87.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.609 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.02 -46.45 90.7 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.673 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.34 -39.22 93.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.914 0.388 . . . . 0.0 110.815 178.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' A' ' 5' ' ' ASP . 52.0 tp -64.79 -44.09 91.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.16 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -73.94 -32.8 63.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.0 -177.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.6 tttm -90.29 -3.37 57.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.729 0.3 . . . . 0.0 111.787 -173.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -114.48 148.79 41.02 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.817 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 18.7 Cg_endo -61.18 132.82 43.41 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.891 2.394 . . . . 0.0 112.634 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 38.1 Cg_exo -61.12 153.04 67.43 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 123.372 2.715 . . . . 0.0 112.76 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -66.07 126.6 29.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.364 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 . . . . . 0 C--O 1.235 0.318 0 O-C-N 123.631 0.582 . . . . 0.0 111.391 -177.327 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.48 ' HE1' HD21 ' A' ' 3' ' ' LEU . 26.3 ttt . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.855 0.359 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.65 120.39 64.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.56 -0.534 . . . . 0.0 109.56 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.48 HD21 ' HE1' ' A' ' 1' ' ' MET . 2.4 mm? -70.38 -34.02 72.09 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.1 -47.43 65.26 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.416 0.447 . . . . 0.0 110.925 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -67.81 -48.06 67.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.155 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.15 78.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.737 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 84.2 mt -62.38 -45.53 98.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.73 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.1 ttm -73.98 -24.41 59.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.294 -175.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -65.45 -43.0 91.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 174.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -79.38 -44.3 21.77 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.571 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -122.6 92.85 48.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.354 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.18 -24.24 38.44 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.905 2.404 . . . . 0.0 112.637 -177.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -94.27 10.1 35.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.603 0.716 . . . . 0.0 110.359 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . . . -80.51 95.36 6.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.455 174.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.2 t -77.92 110.31 13.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.48 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.456 ' C ' ' H ' ' A' ' 18' ' ' LYS . 18.3 m -64.99 153.55 40.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.988 176.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 16' ' ' SER . 58.8 mtt180 75.33 -33.9 0.24 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.558 0.743 . . . . 0.0 111.004 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.456 ' H ' ' C ' ' A' ' 16' ' ' SER . 42.4 tptt -80.02 -59.99 2.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.133 0.492 . . . . 0.0 110.255 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.593 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 11.7 t70 -100.25 -48.03 4.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.205 -176.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.401 ' CE1' ' HB3' ' A' ' 14' ' ' ALA . 29.8 p90 -131.08 143.83 50.97 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.198 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -129.86 132.99 46.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.423 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 36.2 mt -99.91 154.23 18.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.082 0.468 . . . . 0.0 111.38 -173.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.487 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -124.16 162.68 23.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.455 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -101.82 106.73 17.75 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.34 -40.95 22.77 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.3 -173.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.4 -58.6 0.16 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.539 -0.838 . . . . 0.0 112.417 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -94.2 -5.99 45.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.88 0.371 . . . . 0.0 111.225 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 176.53 179.56 47.02 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.048 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.445 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 10.4 p -105.7 132.45 51.82 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.426 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 52.6 p90 -146.13 -173.59 4.21 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.905 0.384 . . . . 0.0 111.458 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.423 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 23.6 mt -62.15 127.48 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.411 -170.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.487 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 10.2 tp10 -118.66 -58.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 172.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.26 126.95 43.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.12 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -139.7 111.58 7.39 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.95 -11.21 15.37 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.57 -0.452 . . . . 0.0 112.15 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.593 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 60.0 mt -55.3 133.36 49.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.149 0.5 . . . . 0.0 110.896 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 37' ' ' ARG . 54.9 mtt180 -80.12 61.05 3.84 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.532 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.38 141.4 16.32 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.497 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.01 137.16 75.73 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 123.068 2.512 . . . . 0.0 112.204 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.415 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 4.4 mm? -57.74 122.58 57.74 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.231 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 40' ' ' LEU . 18.5 Cg_endo -60.13 158.77 28.78 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.995 2.463 . . . . 0.0 112.234 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 27.5 p -99.81 162.69 12.84 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -51.79 -49.53 62.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.567 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.43 -46.82 83.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.028 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.97 -44.6 94.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.255 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 42' ' ' THR . 82.7 mt -58.47 -46.16 87.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.476 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.81 -34.85 76.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.755 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.413 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 58.8 m -62.57 -42.93 99.85 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.852 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -65.8 -37.11 85.38 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.952 0.406 . . . . 0.0 110.323 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -62.65 -45.51 92.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.005 174.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.54 -36.84 85.0 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.691 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 48' ' ' THR . 43.3 mt-10 -59.6 -46.53 88.69 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.126 174.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.13 -47.3 85.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.949 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -64.82 -28.31 69.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.227 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -95.56 2.51 54.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.99 0.424 . . . . 0.0 110.798 -178.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -90.25 125.69 59.29 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -49.39 145.91 15.04 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.425 2.75 . . . . 0.0 112.792 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -47.77 140.84 17.02 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.708 2.939 . . . . 0.0 113.161 -177.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -77.46 116.84 18.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.649 -176.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.8 177.789 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.863 0.363 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.682 HG22 ' HB2' ' A' ' 29' ' ' SER . 2.9 mp -90.86 122.79 42.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.014 0.435 . . . . 0.0 110.253 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.442 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.2 mm? -61.83 -30.87 71.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.129 -176.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -51.23 -45.73 62.03 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.173 -177.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -63.45 -49.58 73.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.987 0.423 . . . . 0.0 111.191 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.98 -46.25 90.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.515 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -63.34 -41.77 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.15 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.491 ' HE2' ' HA ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -64.37 -29.0 70.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.944 -178.207 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -76.02 -38.17 57.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.804 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.476 ' HD3' ' CE2' ' A' ' 49' ' ' TRP . 42.8 tptt -76.17 -45.46 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.81 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -126.47 83.94 63.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.218 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.58 -21.39 46.02 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.735 2.29 . . . . 0.0 112.091 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.14 4.72 47.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.638 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -98.9 138.24 36.3 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -96.83 121.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-O 120.981 0.42 . . . . 0.0 111.018 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 138.62 58.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.689 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 69.0 13.73 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.615 0.572 . . . . 0.0 111.316 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.478 ' HG3' ' OD1' ' A' ' 19' ' ' ASP . 24.2 tptp -116.26 -72.82 0.67 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.405 177.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.478 ' OD1' ' HG3' ' A' ' 18' ' ' LYS . 3.0 m-20 -101.77 -1.05 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.301 0.572 . . . . 0.0 110.924 -179.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -148.2 124.03 10.59 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 169.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.876 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 34.2 tt0 -110.65 126.57 54.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.126 -176.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.555 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 29.8 mt -103.75 152.86 21.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.996 -173.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.555 ' HD2' ' O ' ' A' ' 22' ' ' LEU . 2.3 mpt_? -133.94 174.59 10.31 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.502 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -89.46 122.17 32.4 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.178 178.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.27 -38.77 26.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.356 0.598 . . . . 0.0 110.206 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.49 -56.99 0.47 Allowed Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.866 -176.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -97.8 -11.0 23.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.557 0.694 . . . . 0.0 109.903 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -168.23 -166.53 27.45 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.71 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.682 ' HB2' HG22 ' A' ' 2' ' ' ILE . 42.3 m -102.39 141.83 34.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.647 0.224 . . . . 0.0 110.514 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.54 177.99 7.39 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 45.1 mt -84.66 131.43 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.624 -177.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.46 -55.24 2.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.164 0.507 . . . . 0.0 109.812 174.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.876 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 4.8 ttmp? -109.91 110.18 21.05 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.382 -176.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -105.33 112.81 26.06 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -118.06 6.06 12.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.184 0.516 . . . . 0.0 110.565 -174.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 57.4 mt -81.28 149.23 29.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.9 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -83.13 40.08 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.362 0.601 . . . . 0.0 110.7 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -128.7 152.78 79.3 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.642 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.33 156.06 67.02 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.317 2.012 . . . . 0.0 111.994 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -71.91 125.32 91.61 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -61.71 159.38 33.07 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.99 2.46 . . . . 0.0 112.599 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.586 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 61.7 p -94.64 156.14 16.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.28 -178.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.0 tm0? -52.41 -45.27 65.82 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.71 0.631 . . . . 0.0 109.832 177.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.2 -51.77 68.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.608 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.7 -34.71 78.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.132 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.4 mt -54.34 -46.54 72.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.88 -26.65 59.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.2 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.8 m -63.89 -46.99 82.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.264 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.476 ' CE2' ' HD3' ' A' ' 10' ' ' LYS . 13.6 m0 -63.78 -35.45 80.65 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.08 0.467 . . . . 0.0 109.782 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -60.96 -49.22 78.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.595 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -64.11 -38.83 92.47 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.666 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.66 -48.82 77.67 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.914 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.9 tp -60.54 -22.22 63.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.128 0.49 . . . . 0.0 110.833 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.78 -46.14 10.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.231 178.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.84 -17.08 42.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -119.37 109.54 38.52 Favored Pre-proline 0 C--N 1.311 -1.098 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.844 -173.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.464 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 71.8 Cg_endo -77.49 140.7 19.35 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.689 2.259 . . . . 0.0 112.38 178.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 13.0 Cg_exo -70.29 152.76 66.74 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.914 2.41 . . . . 0.0 112.045 177.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -70.33 113.6 7.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.993 0.425 . . . . 0.0 110.213 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 . . . . . 0 C--N 1.323 -0.545 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.244 -179.436 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 ppp? . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.5 mp -112.88 128.77 69.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.13 -179.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.479 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.7 mm? -67.59 -40.52 84.79 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.791 0.329 . . . . 0.0 111.376 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.512 ' CD1' HD12 ' A' ' 22' ' ' LEU . 40.4 t80 -52.62 -47.29 67.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.995 -176.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.53 -44.61 93.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.534 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.58 -45.82 85.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.787 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.6 mt -58.86 -48.26 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.69 178.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.466 ' HA ' ' HE3' ' A' ' 8' ' ' MET . 0.0 OUTLIER -62.09 -26.38 68.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.846 -177.825 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -69.2 -49.69 54.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.321 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.628 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 86.1 tttt -77.8 -35.76 51.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.996 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -117.8 79.84 13.6 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.852 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.423 ' HD3' ' O ' ' A' ' 10' ' ' LYS . 3.4 Cg_exo -78.38 -23.3 8.81 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.964 2.443 . . . . 0.0 112.066 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -85.19 -6.48 59.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.76 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.4 127.93 34.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.521 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.8 t -82.7 121.13 35.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.093 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.3 t -69.0 143.25 54.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.191 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.401 ' HA ' ' HG2' ' A' ' 21' ' ' GLU . 81.5 mtt180 63.14 21.43 12.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.964 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -109.29 -69.64 0.85 Allowed 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.418 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -99.43 -46.21 5.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.45 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 32.8 p90 -100.68 138.16 38.12 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 175.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.454 ' CB ' ' HB3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -131.1 142.53 50.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.041 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.512 HD12 ' CD1' ' A' ' 4' ' ' TYR . 14.0 mt -101.71 144.81 29.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.842 -172.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -143.43 169.37 17.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.552 176.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -106.09 112.28 25.26 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.609 -176.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.586 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 30.8 t70 -79.64 -28.37 40.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.803 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 175.84 -95.44 0.1 Allowed Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.484 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -95.91 35.29 1.42 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.483 0.658 . . . . 0.0 109.789 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.77 148.9 7.12 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.97 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 m -99.17 129.05 45.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.586 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -134.78 -168.68 2.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.946 0.403 . . . . 0.0 110.971 -173.114 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -81.96 132.69 30.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.174 177.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -125.23 -53.67 1.61 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.454 ' HB3' ' CB ' ' A' ' 21' ' ' GLU . 58.2 tttm -94.55 122.91 37.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.875 178.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -136.47 111.01 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -118.15 3.71 12.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.249 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.7 mt -71.86 137.62 47.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -79.81 59.58 3.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.87 0.843 . . . . 0.0 110.238 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -139.76 150.58 63.4 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.136 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.57 147.85 46.59 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.187 1.925 . . . . 0.0 111.898 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.11 130.87 93.19 Favored Pre-proline 0 N--CA 1.449 -0.49 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.03 176.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.42 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 41.8 Cg_endo -68.19 168.61 18.75 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.848 2.365 . . . . 0.0 112.994 -177.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.501 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 41.1 p -104.33 165.29 11.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.546 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -57.36 -43.77 83.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.291 0.567 . . . . 0.0 109.735 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.79 -47.82 73.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.97 -1.014 . . . . 0.0 110.633 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.426 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 30.4 mt-10 -58.24 -53.42 58.48 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 176.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.8 mt -52.31 -49.09 64.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.627 -177.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.72 -33.45 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.627 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 91.8 m -64.08 -45.28 89.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.554 0.216 . . . . 0.0 110.556 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.628 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.0 m0 -63.72 -42.13 97.98 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -63.1 -44.31 96.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.801 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -62.29 -46.73 87.44 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.497 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.529 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 45.5 mt-10 -64.0 -37.35 87.1 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.861 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.9 tp -65.09 -30.03 70.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.869 0.366 . . . . 0.0 110.914 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -91.39 -39.76 11.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.091 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -88.4 -15.8 34.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.162 0.506 . . . . 0.0 111.447 -173.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.529 ' HB3' ' O ' ' A' ' 52' ' ' GLU . 9.0 t30 -110.68 122.75 37.4 Favored Pre-proline 0 C--N 1.315 -0.929 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.533 176.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 56' ' ' ASN . 11.5 Cg_exo -70.78 117.25 5.04 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.865 2.377 . . . . 0.0 112.536 -177.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -75.91 138.32 20.79 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.777 2.318 . . . . 0.0 110.964 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -88.25 121.83 31.1 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.86 0.362 . . . . 0.0 110.62 -176.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.702 177.998 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 ttt . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.468 ' N ' HD13 ' A' ' 2' ' ' ILE . 3.9 mp -87.13 112.62 23.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.441 HD13 HD11 ' A' ' 46' ' ' LEU . 2.9 mm? -70.13 -34.36 72.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.113 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -51.17 -49.18 61.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.861 -175.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.25 -51.09 70.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.339 -177.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.72 90.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.461 -177.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 3' ' ' LEU . 77.8 mt -63.25 -47.86 90.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.249 -178.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.4 ttm -76.25 -16.99 59.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.969 0.414 . . . . 0.0 111.012 -174.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.436 ' CD2' ' HB3' ' A' ' 49' ' ' TRP . 92.4 t80 -69.38 -44.72 70.9 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 174.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -82.07 -37.21 26.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.092 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -124.17 97.74 39.91 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 121.069 0.462 . . . . 0.0 111.226 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -66.53 -27.81 45.93 Favored 'Trans proline' 0 CA--C 1.528 0.185 0 C-N-CA 122.857 2.371 . . . . 0.0 112.567 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -87.34 8.82 22.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.667 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.509 ' HB2' ' CE1' ' A' ' 20' ' ' PHE . . . -78.71 107.06 11.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.895 0.379 . . . . 0.0 110.526 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.67 105.83 15.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.406 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m -70.03 140.97 52.94 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.441 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 71.38 12.4 6.65 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.577 177.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -116.38 -76.48 0.57 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -91.5 -31.24 16.03 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.147 0.499 . . . . 0.0 110.415 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.509 ' CE1' ' HB2' ' A' ' 14' ' ' ALA . 17.2 p90 -127.62 135.67 50.58 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 170.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -130.51 139.96 50.5 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.464 0.649 . . . . 0.0 110.557 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.0 mt -93.61 146.86 23.51 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.493 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.401 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.9 mpt_? -130.92 169.8 15.31 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 176.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -92.3 117.86 30.32 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.441 -175.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -86.82 -26.24 24.16 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 132.18 -38.31 1.91 Allowed Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.03 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -87.44 -22.34 25.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.355 0.598 . . . . 0.0 110.427 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 171.02 -160.24 32.58 Favored Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.351 177.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 m -99.24 112.3 24.49 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -116.9 173.63 6.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.442 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.6 mt -69.96 114.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.248 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.401 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 1.6 tm-20 -121.1 -53.62 2.04 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.664 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.82 116.91 32.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -129.36 111.86 13.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -114.55 3.88 15.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.921 0.391 . . . . 0.0 110.813 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.8 mt -70.66 145.58 50.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.89 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -81.79 49.03 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.144 0.497 . . . . 0.0 110.396 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.425 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . . . -146.17 140.05 15.11 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.808 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 38' ' ' ALA . 38.6 Cg_exo -61.92 148.25 93.52 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.075 2.517 . . . . 0.0 112.59 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.08 142.95 90.82 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.296 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.19 171.72 16.27 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.387 2.058 . . . . 0.0 110.963 170.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.7 p -104.6 167.77 9.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.49 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -56.61 -47.95 78.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.136 0.493 . . . . 0.0 110.021 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.11 -48.88 73.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.172 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -57.39 -49.73 75.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.303 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.441 HD11 HD13 ' A' ' 3' ' ' LEU . 91.7 mt -55.59 -47.74 76.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.046 0.45 . . . . 0.0 111.184 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -75.9 -18.0 59.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.635 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.3 m -64.92 -50.08 67.88 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.436 ' HB3' ' CD2' ' A' ' 9' ' ' TYR . 8.1 m0 -67.26 -31.74 72.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.22 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -62.09 -44.77 95.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.927 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -60.8 -46.19 91.49 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.842 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.39 -35.8 81.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.915 0.388 . . . . 0.0 111.0 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.3 tp -65.42 -38.84 91.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.667 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.71 -25.37 41.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.127 0.489 . . . . 0.0 110.435 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.434 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 43.2 tttm -87.16 18.92 3.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.244 178.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 55' ' ' LYS . 11.5 t30 78.29 107.78 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.386 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.408 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.449 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 40.1 Cg_endo -68.31 128.63 17.72 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.939 2.426 . . . . 0.0 112.171 179.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 9.4 Cg_exo -71.2 168.1 24.31 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.936 2.424 . . . . 0.0 112.482 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -108.35 133.34 52.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.703 177.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 . . . . . 0 C--N 1.326 -0.439 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.152 -179.114 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.407 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.4 mp -104.87 115.31 46.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.492 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.2 OUTLIER -63.44 -32.76 74.29 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.096 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -52.98 -48.57 67.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.084 -176.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.6 -48.8 79.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.351 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.69 -43.78 85.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.432 178.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -67.09 -38.31 80.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.54 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.581 ' HE2' ' HA ' ' A' ' 8' ' ' MET . 15.0 mmt -68.64 -22.5 64.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.481 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -79.25 -38.31 35.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.848 0.356 . . . . 0.0 110.309 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? -80.68 -50.78 9.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.96 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -118.81 85.33 27.79 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.992 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.64 -20.85 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.624 2.216 . . . . 0.0 112.879 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -90.1 -8.34 51.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.073 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.14 141.93 58.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.327 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.43 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 33.4 t -104.12 128.44 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.14 0.495 . . . . 0.0 110.738 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 p -70.67 141.81 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.321 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 17' ' ' ARG . 43.2 mtt180 65.55 25.12 11.77 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.513 0.673 . . . . 0.0 110.705 -176.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.43 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 84.8 tttt -140.92 -60.16 0.5 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.382 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.418 ' HB3' HD23 ' A' ' 36' ' ' LEU . 33.8 m-20 -86.98 -38.36 16.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.865 176.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 p90 -152.26 149.37 28.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.043 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.58 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 66.7 tt0 -136.02 135.39 39.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.45 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 48.9 mt -117.24 155.19 29.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.863 0.363 . . . . 0.0 111.627 -170.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 29' ' ' SER . 5.6 mpt_? -124.22 173.73 8.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.017 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -98.43 119.55 37.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.655 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -81.1 -33.08 33.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.226 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.96 -36.25 3.51 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -170.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -95.33 9.41 39.97 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 173.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 134.27 -176.7 19.68 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.789 -178.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.448 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 11.1 m -84.67 130.57 34.69 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -120.42 171.43 8.54 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 110.606 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.492 HG13 ' HG ' ' A' ' 3' ' ' LEU . 62.7 mt -82.33 121.77 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.23 -176.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -108.75 -58.41 2.01 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 176.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 32.0 mmtp -99.17 131.74 44.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.516 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -133.58 111.62 10.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 175.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -114.18 1.29 14.5 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.081 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.418 HD23 ' HB3' ' A' ' 19' ' ' ASP . 76.8 mt -78.73 147.71 33.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 -177.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.7 mtp180 -87.5 36.06 0.74 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.432 177.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.23 141.1 38.81 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.006 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.79 148.73 93.05 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.826 2.35 . . . . 0.0 112.459 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.91 128.59 93.37 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.661 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.404 ' HG2' HD21 ' A' ' 46' ' ' LEU . 56.1 Cg_endo -71.23 171.67 15.57 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.546 2.164 . . . . 0.0 111.909 176.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.462 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.9 p -93.6 165.29 12.8 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.702 -177.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -59.22 -39.66 83.37 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.168 178.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.92 95.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.314 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.55 -48.48 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.879 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 42' ' ' THR . 99.7 mt -55.35 -47.2 76.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.336 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.39 -28.28 66.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.0 m -62.94 -50.76 69.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.565 0.222 . . . . 0.0 110.807 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -65.1 -38.56 91.1 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-O 120.974 0.416 . . . . 0.0 110.276 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -58.76 -49.26 78.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.714 177.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.86 -44.51 96.91 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 123.141 0.576 . . . . 0.0 111.765 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.488 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.26 -38.08 82.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.903 0.382 . . . . 0.0 110.474 177.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -69.65 -38.87 77.3 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.544 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -79.65 -13.18 59.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.898 0.38 . . . . 0.0 111.884 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.413 ' HA ' ' HD3' ' A' ' 57' ' ' PRO . 84.2 m-20 -97.36 155.56 37.21 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-O 120.918 0.389 . . . . 0.0 111.721 -175.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 56' ' ' ASN . 3.8 Cg_exo -77.18 164.46 29.25 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.383 2.722 . . . . 0.0 111.603 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -67.67 146.65 73.94 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.574 2.183 . . . . 0.0 112.291 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -84.25 146.46 27.77 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 . . . . . 0 C--N 1.325 -0.474 0 O-C-N 123.229 0.33 . . . . 0.0 111.531 -178.53 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.439 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.0 mp -104.43 111.1 32.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.929 0.395 . . . . 0.0 110.151 178.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.714 ' HG ' HG13 ' A' ' 31' ' ' ILE . 2.8 mm? -70.04 -30.59 67.91 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.4 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -50.45 -40.4 50.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.79 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -67.56 -55.3 14.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.61 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.87 86.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.57 -176.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.0 mt -64.06 -44.86 97.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.268 -177.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 69.9 mtp -81.88 -9.04 59.71 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.485 -176.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -77.39 -38.9 48.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.633 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 61.9 tttm -81.35 -38.19 27.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.239 177.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.504 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 85.1 m-85 -121.08 98.58 47.16 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.536 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.77 -24.49 68.64 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.609 2.206 . . . . 0.0 111.973 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -98.53 17.86 18.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.043 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.504 ' HB1' ' HB2' ' A' ' 11' ' ' TYR . . . -86.76 101.41 13.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.141 0.496 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 37.7 t -88.79 117.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.449 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 p -72.04 150.6 43.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.468 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 64.88 23.05 12.59 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -125.05 -72.06 0.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.037 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.7 t0 -109.25 4.83 23.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.786 0.803 . . . . 0.0 110.022 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.486 ' CE1' ' HB2' ' A' ' 14' ' ' ALA . 39.6 p90 -165.27 127.18 2.07 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 171.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -113.33 130.42 56.27 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.126 0.489 . . . . 0.0 111.169 -172.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.34 153.2 24.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.667 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.494 ' NH1' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -133.32 173.96 10.91 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.246 0.546 . . . . 0.0 111.208 176.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -99.52 123.62 43.96 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.204 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.412 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 7.1 t70 -98.19 -34.64 10.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.224 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.74 -29.14 5.94 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -174.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -100.36 -8.93 22.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.611 0.72 . . . . 0.0 109.588 175.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.8 177.42 30.89 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.776 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.2 m -96.13 115.48 27.5 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.412 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 53.5 p90 -106.17 171.24 7.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.806 -172.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.714 HG13 ' HG ' ' A' ' 3' ' ' LEU . 58.5 mt -87.45 118.71 33.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.977 176.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.494 ' HG2' ' NH1' ' A' ' 23' ' ' ARG . 8.9 tp10 -101.97 -56.55 2.25 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.78 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -121.29 113.09 19.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.336 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.433 ' CH2' HD12 ' A' ' 36' ' ' LEU . 58.1 t-105 -106.83 112.53 25.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.173 -174.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 6.1 m-20 -110.86 1.94 17.94 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -177.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.433 HD12 ' CH2' ' A' ' 34' ' ' TRP . 90.7 mt -69.57 141.42 53.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.32 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -82.59 41.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.489 0.661 . . . . 0.0 110.748 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.13 142.17 40.84 Favored Pre-proline 0 C--N 1.315 -0.935 0 CA-C-N 115.104 -0.953 . . . . 0.0 108.774 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.4 155.74 50.54 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.381 2.054 . . . . 0.0 111.962 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.8 120.55 69.75 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.598 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -62.69 168.83 9.47 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.918 2.412 . . . . 0.0 112.117 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.4 p -94.1 167.03 11.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.74 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -62.57 -44.19 96.93 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.898 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.79 -45.05 86.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.208 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -57.7 -54.11 50.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.818 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.436 ' HA ' ' CE3' ' A' ' 49' ' ' TRP . 93.3 mt -55.21 -46.21 75.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.826 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.77 -20.77 59.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -177.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 88.5 m -70.83 -44.35 66.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.107 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.633 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 9.5 m0 -64.31 -36.97 85.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.422 ' O ' ' HB2' ' A' ' 54' ' ' GLN . 62.0 t-105 -60.97 -42.75 98.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.312 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -70.51 -43.39 69.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.23 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -61.8 -40.78 96.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 58.5 tp -68.38 -34.35 75.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.525 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 50' ' ' TRP . 0.4 OUTLIER -72.61 -25.17 61.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.063 0.458 . . . . 0.0 110.541 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 74.5 tttt -78.65 -6.76 56.55 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.506 175.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.3 t30 71.52 109.2 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.313 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.284 -174.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.68 144.61 99.4 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.048 2.498 . . . . 0.0 112.888 -177.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.27 -177.88 1.91 Allowed 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.048 2.499 . . . . 0.0 112.401 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -60.42 120.04 9.14 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.893 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.002 -179.891 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.425 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 1.3 tmt? . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.4 mp -106.28 124.52 61.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.267 -177.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.607 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 0.2 OUTLIER -65.86 -32.98 74.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.515 179.435 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.459 ' HE1' ' OG ' ' A' ' 16' ' ' SER . 81.8 t80 -52.17 -47.63 65.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.258 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.44 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 0.9 OUTLIER -60.4 -47.81 84.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.401 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.89 99.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.12 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 3' ' ' LEU . 82.1 mt -63.49 -43.25 98.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.15 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.571 ' HE2' ' HA ' ' A' ' 8' ' ' MET . 30.6 mmt -67.71 -23.29 65.26 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.165 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -81.39 -37.7 27.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.938 0.399 . . . . 0.0 110.437 177.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -82.78 -50.81 8.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.382 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -132.33 88.02 41.13 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.467 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -68.35 -13.12 36.89 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.744 2.296 . . . . 0.0 111.3 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -75.93 -13.74 60.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.875 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.9 137.63 32.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.534 ' HB ' ' HD3' ' A' ' 18' ' ' LYS . 47.7 t -99.34 129.36 49.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.89 0.376 . . . . 0.0 110.743 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.459 ' OG ' ' HE1' ' A' ' 4' ' ' TYR . 14.9 m -62.92 134.4 56.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.253 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 70.8 3.98 4.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.533 0.733 . . . . 0.0 111.553 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.534 ' HD3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -110.96 -63.84 1.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.851 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.538 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 52.5 m-20 -90.0 -17.71 27.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.288 -177.218 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.2 p90 -153.51 130.35 10.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.473 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 33.2 tt0 -109.79 126.39 53.72 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 mt -90.77 150.85 21.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.612 0.72 . . . . 0.0 111.542 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -139.68 154.75 47.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.502 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -86.3 123.7 31.84 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.057 0.456 . . . . 0.0 110.783 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.45 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 1.7 t70 -88.86 -32.69 17.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.325 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.07 -43.61 1.52 Allowed Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -79.5 -20.03 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.451 0.644 . . . . 0.0 109.579 173.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.425 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 163.72 -172.07 39.52 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.317 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -88.19 121.66 30.84 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.607 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.3 p90 -117.94 -178.06 3.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.447 -0.205 . . . . 0.0 110.447 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.423 HD13 HD13 ' A' ' 7' ' ' ILE . 31.0 mt -91.11 121.6 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.972 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -98.65 -53.33 3.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 2.8 tppp? -94.76 104.52 16.43 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.351 178.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 61.5 t-105 -87.03 108.89 19.06 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 168.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -106.91 -2.97 20.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.463 0.649 . . . . 0.0 110.41 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.538 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 73.2 mt -86.95 147.62 25.68 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.873 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.2 mtp180 -92.57 36.2 1.01 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.47 ' HB2' ' HD2' ' A' ' 39' ' ' PRO . . . -111.2 161.74 23.83 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 114.41 -1.268 . . . . 0.0 109.943 -177.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.47 ' HD2' ' HB2' ' A' ' 38' ' ' ALA . 30.8 Cg_endo -64.39 150.05 88.97 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.642 2.228 . . . . 0.0 112.468 178.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.58 134.08 51.64 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.898 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.97 164.37 33.98 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.487 2.125 . . . . 0.0 111.375 172.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.594 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 70.3 p -95.87 167.63 11.13 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.704 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.468 HE21 ' HG3' ' A' ' 47' ' ' GLU . 23.2 tp60 -55.88 -46.81 78.22 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.343 0.592 . . . . 0.0 109.534 173.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.75 70.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.847 176.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.01 -46.62 87.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.415 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 42' ' ' THR . 87.4 mt -57.08 -44.52 83.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.909 0.385 . . . . 0.0 111.023 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.468 ' HG3' HE21 ' A' ' 43' ' ' GLN . 48.6 mt-10 -75.02 -24.64 58.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.056 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.8 m -73.07 -41.43 64.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.398 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 51.2 m0 -66.58 -31.98 73.03 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -64.46 -36.11 83.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.944 174.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.11 -50.25 49.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.295 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -62.22 -32.79 73.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.694 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.44 ' CD2' ' HB3' ' A' ' 5' ' ' ASP . 44.9 tp -61.11 -43.06 99.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.036 176.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -76.65 -31.62 57.45 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.491 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -74.01 -15.17 61.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.892 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -148.35 80.19 8.6 Favored Pre-proline 0 C--N 1.317 -0.811 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.3 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -71.94 161.89 43.54 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.924 2.416 . . . . 0.0 112.799 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -53.51 149.02 32.32 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 122.885 2.39 . . . . 0.0 111.854 176.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -64.86 125.25 24.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.177 0.513 . . . . 0.0 111.214 -173.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 . . . . . 0 C--N 1.323 -0.578 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.008 178.981 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.439 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.602 HG22 ' HB2' ' A' ' 29' ' ' SER . 4.2 mp -108.47 128.86 63.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.208 -177.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.43 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -66.12 -32.55 74.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.399 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.4 ' H ' HG23 ' A' ' 2' ' ' ILE . 84.3 t80 -52.39 -45.56 65.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.685 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.36 -49.94 75.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 0.0 111.201 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.32 -45.08 95.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.295 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.29 -47.08 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.888 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.26 -29.64 70.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.83 -177.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -68.23 -45.34 73.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.048 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -81.17 -35.8 30.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.887 -178.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -121.72 89.03 47.51 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.554 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -66.39 -22.01 53.05 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.983 2.455 . . . . 0.0 112.336 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -102.8 23.99 11.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.235 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.53 106.28 18.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.512 HG12 ' HD2' ' A' ' 18' ' ' LYS . 19.5 t -76.47 113.59 15.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.153 0.502 . . . . 0.0 111.201 -175.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.3 p -66.81 139.01 57.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.742 -178.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 68.8 6.93 5.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.448 -0.797 . . . . 0.0 112.099 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.512 ' HD2' HG12 ' A' ' 15' ' ' VAL . 50.1 mttp -119.18 -55.49 2.15 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.842 0.353 . . . . 0.0 110.265 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.442 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 10.7 t70 -91.66 -50.32 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.95 178.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -120.27 141.08 50.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.646 176.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.637 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 80.4 tt0 -129.51 131.09 46.55 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -177.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 mt -112.53 153.54 27.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.796 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.408 ' HD3' ' HA ' ' A' ' 23' ' ' ARG . 9.7 tpp180 -123.12 157.01 33.83 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.421 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -98.97 132.09 44.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.085 0.469 . . . . 0.0 111.357 -171.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -90.97 -48.3 7.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.689 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.55 -47.37 0.93 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -173.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -92.4 6.19 47.92 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.654 0.74 . . . . 0.0 109.695 174.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.439 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 161.93 -164.92 35.59 Favored Glycine 0 N--CA 1.441 -0.977 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.674 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.602 ' HB2' HG22 ' A' ' 2' ' ' ILE . 18.4 m -130.16 136.34 49.17 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 46.4 p90 -120.6 173.1 7.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.986 -173.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.43 HG13 ' HG ' ' A' ' 3' ' ' LEU . 29.7 mt -95.78 137.25 24.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.507 -175.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -129.46 -22.96 2.98 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.831 0.348 . . . . 0.0 111.184 167.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.637 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 20.7 mmtp -117.15 135.7 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.417 177.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -154.43 111.67 3.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -110.39 -9.97 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.783 179.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.442 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 69.5 mt -56.62 133.27 53.59 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.174 0.512 . . . . 0.0 111.372 -178.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -80.84 51.44 1.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.384 -178.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.18 144.42 31.52 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.159 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.29 148.06 93.9 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.725 2.283 . . . . 0.0 112.3 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.28 133.77 95.6 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.944 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.63 169.21 21.59 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.974 2.449 . . . . 0.0 112.201 178.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 23.4 p -99.96 166.83 10.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.448 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -62.89 -39.03 93.25 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.53 91.14 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.423 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.88 -44.53 96.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.884 177.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 42' ' ' THR . 98.6 mt -59.74 -44.25 93.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.849 178.351 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 43' ' ' GLN . 53.3 mt-10 -60.94 -40.21 92.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.008 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.403 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 7.9 m -64.82 -48.12 75.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.47 -177.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -62.8 -35.03 78.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.152 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.507 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -61.5 -53.26 58.79 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.83 -43.53 90.71 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 48' ' ' THR . 42.4 mt-10 -58.77 -46.62 87.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.883 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 55.4 tp -62.27 -31.85 72.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.213 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.6 mm-40 -79.98 -39.19 30.61 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.502 -178.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -84.29 -16.91 41.37 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -95.82 154.87 38.95 Favored Pre-proline 0 C--N 1.311 -1.09 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.695 -179.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.06 126.76 21.13 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.475 2.117 . . . . 0.0 111.183 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.12 169.17 9.61 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.677 2.252 . . . . 0.0 112.907 -176.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -57.72 117.03 3.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.486 -178.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.376 -179.742 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.484 1.264 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.4 mp -106.34 106.4 20.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.994 0.426 . . . . 0.0 110.342 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.6 mm? -70.79 -32.67 69.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.41 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -51.37 -54.21 28.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.431 -175.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.89 -47.84 79.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.49 -179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.51 -49.53 74.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -69.11 -42.05 81.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.122 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.558 ' HA ' ' HE3' ' A' ' 8' ' ' MET . 1.2 tpt -63.74 -35.37 80.36 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.965 0.412 . . . . 0.0 110.816 -177.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -70.82 -43.66 68.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.129 178.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.42 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 6.3 tmtm? -70.72 -47.22 60.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.741 -176.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.42 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 80.3 m-85 -120.64 92.39 47.85 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.296 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -63.87 -27.56 67.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.463 2.109 . . . . 0.0 112.396 -178.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -94.27 12.75 25.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.424 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.88 122.35 33.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.192 0.52 . . . . 0.0 110.156 175.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -100.27 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.148 -176.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 9.2 p -84.07 39.96 0.73 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 122.003 0.906 . . . . 0.0 111.474 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.439 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 77.2 mtt180 -95.49 -72.59 0.62 Allowed 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.315 176.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.439 ' HD2' ' HB3' ' A' ' 17' ' ' ARG . 3.3 mptp? -114.66 -37.09 4.34 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.6 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.31 -44.15 88.45 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.825 0.822 . . . . 0.0 109.957 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.404 ' O ' ' HA ' ' A' ' 16' ' ' SER . 20.4 p90 -148.92 149.04 30.54 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 168.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -136.7 133.02 35.68 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.263 0.554 . . . . 0.0 110.958 -174.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.3 mt -94.85 153.92 17.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.116 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -135.22 154.21 51.66 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -178.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -75.24 123.74 25.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.542 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 11.7 t70 -87.35 -28.35 22.27 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.715 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.15 -43.56 1.69 Allowed Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 -173.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -100.31 10.67 40.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.977 0.894 . . . . 0.0 109.099 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.14 -160.55 30.53 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.779 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.508 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 19.3 m -130.92 121.51 25.31 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.542 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -125.74 -179.17 4.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.841 0.353 . . . . 0.0 110.924 -173.548 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.3 mt -84.04 118.99 32.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.144 0.497 . . . . 0.0 111.318 -175.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -90.14 -56.22 3.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.002 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -115.84 148.4 39.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.885 -178.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -150.44 111.39 4.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.267 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -120.05 7.38 10.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.044 0.45 . . . . 0.0 110.505 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.3 147.6 51.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -86.88 51.15 2.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.619 0.723 . . . . 0.0 109.983 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.32 146.33 57.51 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.302 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.45 136.61 77.06 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.865 2.377 . . . . 0.0 112.581 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.85 116.94 24.12 Favored Pre-proline 0 C--N 1.333 -0.138 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -60.47 151.0 78.09 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.672 2.248 . . . . 0.0 112.164 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.5 p -99.34 175.43 5.87 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.416 -178.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -53.79 -52.29 60.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.174 0.511 . . . . 0.0 110.759 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.63 -48.1 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -58.92 -49.94 75.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.459 HD23 HD11 ' A' ' 3' ' ' LEU . 80.2 mt -57.87 -49.11 77.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.207 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 42.4 mt-10 -69.15 -33.53 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.833 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -62.48 -41.9 99.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.682 0.277 . . . . 0.0 110.883 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -66.83 -35.2 79.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 110.257 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -66.66 -40.89 88.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.964 174.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.0 mt-10 -63.21 -43.9 96.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.264 177.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 39.0 mt-10 -62.33 -40.34 96.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.443 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 tp -65.94 -40.42 91.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.053 0.454 . . . . 0.0 110.454 176.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -66.0 -32.08 73.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.376 0.608 . . . . 0.0 110.615 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 46.5 tttm -100.06 14.23 31.35 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.856 -178.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 64.0 t30 -100.12 127.4 33.46 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 122.145 -0.347 . . . . 0.0 111.175 -177.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.421 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 24.6 Cg_exo -64.07 135.27 46.59 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.406 2.071 . . . . 0.0 110.106 167.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 31.7 Cg_exo -56.93 146.26 80.52 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.752 2.302 . . . . 0.0 113.361 -172.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -81.74 109.43 16.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.468 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.464 -177.366 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.6 mp -104.79 112.59 39.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.898 0.38 . . . . 0.0 110.434 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.519 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.6 mm? -70.41 -32.56 70.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.805 -178.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.501 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . 70.0 t80 -49.89 -52.42 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.74 -173.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.537 ' HB3' HD13 ' A' ' 53' ' ' LEU . 6.2 m-20 -66.76 -49.39 66.08 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.855 -177.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.23 -44.54 75.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.824 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 3' ' ' LEU . 73.2 mt -66.95 -48.83 78.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.694 -176.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.2 mtp -74.37 -22.26 59.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.161 -174.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -71.98 -37.81 69.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.093 0.473 . . . . 0.0 110.19 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -79.21 -48.92 13.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.993 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -116.14 101.17 53.94 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.914 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.41 -14.5 28.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.771 2.314 . . . . 0.0 112.369 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -94.13 4.97 53.15 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.219 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -100.69 117.73 35.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.757 0.313 . . . . 0.0 110.441 -177.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.543 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 45.3 t -95.77 129.29 46.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.832 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -68.15 139.49 56.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 17' ' ' ARG . 58.0 mtt-85 66.54 6.06 4.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.59 -177.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.543 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -109.95 -64.95 1.2 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.457 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 46.2 m-20 -93.08 -25.64 17.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.913 -176.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.495 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 44.9 p90 -147.91 131.82 17.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.427 177.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.823 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 31.2 tt0 -120.06 134.97 55.1 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.501 ' CD1' ' HB2' ' A' ' 4' ' ' TYR . 35.9 mt -95.79 153.67 17.62 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.656 -170.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.0 162.8 34.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.648 175.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 -100.16 135.4 41.65 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 120.835 0.35 . . . . 0.0 110.647 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.413 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 12.9 t70 -99.39 -42.01 7.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.289 0.566 . . . . 0.0 109.996 175.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.45 -63.22 0.16 Allowed Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 -178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -112.0 17.4 19.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.584 0.706 . . . . 0.0 110.104 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -170.52 163.87 37.09 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.873 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 16.3 m -115.92 116.17 27.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.413 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 19.8 p90 -113.55 -175.96 2.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.587 -175.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 mt -89.96 126.48 42.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.799 0.333 . . . . 0.0 111.649 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -104.9 -56.17 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 172.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.823 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 17.3 mmtm -85.91 104.27 15.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.928 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 28.9 t-105 -101.95 112.34 24.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 174.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.457 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 30.8 m-80 -116.39 17.24 15.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.288 -175.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.9 mt -106.67 149.62 27.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.395 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -89.46 35.93 0.83 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.293 0.568 . . . . 0.0 110.064 177.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -114.51 141.8 27.17 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.345 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -64.57 141.92 75.43 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 123.109 2.539 . . . . 0.0 111.852 175.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.445 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 4.0 mm? -66.75 138.37 95.34 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.583 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 40' ' ' LEU . 6.2 Cg_exo -77.39 -174.84 2.37 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.22 2.614 . . . . 0.0 112.248 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 82.1 p -105.04 170.86 7.63 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.442 -178.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.27 -48.08 81.49 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.144 0.278 . . . . 0.0 110.922 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.47 -44.09 72.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.04 -55.17 38.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.398 177.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.5 mt -56.41 -47.14 79.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.9 -29.54 67.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.089 -176.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 87.9 m -67.24 -44.2 80.02 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.376 178.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.428 ' CZ3' HD22 ' A' ' 46' ' ' LEU . 25.3 m0 -60.82 -45.17 95.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.157 0.503 . . . . 0.0 109.88 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.4 t-105 -59.27 -47.92 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.771 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.04 -41.46 95.19 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.167 -0.469 . . . . 0.0 112.243 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -60.12 -40.87 91.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.768 0.318 . . . . 0.0 110.713 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.537 HD13 ' HB3' ' A' ' 5' ' ' ASP . 9.9 tt -64.96 -42.19 94.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.778 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -69.01 -35.89 77.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.274 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -92.18 6.56 46.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.032 -175.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -93.32 129.76 37.92 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.824 178.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.59 160.21 1.8 Allowed 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 123.157 2.571 . . . . 0.0 112.472 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.24 157.36 17.95 Favored 'Trans proline' 0 C--O 1.238 0.491 0 C-N-CA 123.147 2.564 . . . . 0.0 113.382 -175.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -82.16 143.15 31.63 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.995 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 . . . . . 0 C--O 1.238 0.453 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.604 178.259 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.1 mp -113.44 116.71 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.13 -32.35 73.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.926 0.393 . . . . 0.0 110.823 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -52.27 -48.42 65.3 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.1 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -61.63 -51.27 69.18 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.524 -178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.92 -46.35 88.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.569 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 84.4 mt -67.65 -46.26 83.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.966 -178.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.539 ' HE3' ' HA ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -66.03 -31.66 72.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.005 0.431 . . . . 0.0 110.694 -176.933 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.413 ' OH ' ' HB3' ' A' ' 52' ' ' GLU . 13.5 t80 -63.76 -51.64 63.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.112 177.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.4 tttp -81.75 -43.11 18.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.616 -174.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -123.03 94.08 47.61 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.937 0.398 . . . . 0.0 110.708 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.539 ' HA ' ' HE3' ' A' ' 8' ' ' MET . 61.2 Cg_endo -73.77 -18.11 22.34 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.675 2.25 . . . . 0.0 112.5 -177.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.39 1.73 43.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.295 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.434 ' HB2' ' CE1' ' A' ' 20' ' ' PHE . . . -87.26 143.47 27.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.1 0.476 . . . . 0.0 111.054 -179.099 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 98.7 t -127.32 123.14 61.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.449 177.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -88.96 37.43 0.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.713 0.768 . . . . 0.0 111.475 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -99.23 -55.86 2.57 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.596 170.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -105.47 -67.32 0.93 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.904 -168.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.506 ' HB3' HD22 ' A' ' 36' ' ' LEU . 3.9 m-20 -52.48 -39.69 61.48 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.54 -175.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.434 ' CE1' ' HB2' ' A' ' 14' ' ' ALA . 37.8 p90 -158.17 176.96 11.82 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 45.1 tt0 -152.47 148.8 27.84 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.931 0.396 . . . . 0.0 110.468 179.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 31' ' ' ILE . 17.2 mt -116.7 145.53 43.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.678 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.543 ' HD2' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mtt180 -141.99 148.44 38.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.256 0.551 . . . . 0.0 110.832 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -92.98 121.97 34.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.921 -175.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.75 -47.01 6.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.504 179.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.06 -35.25 1.86 Allowed Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -76.63 -25.56 53.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.921 0.867 . . . . 0.0 108.928 169.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 165.34 -175.09 41.19 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.251 -1.34 . . . . 0.0 111.549 -179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.5 m -108.35 108.97 20.17 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -121.66 -177.57 3.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.716 0.293 . . . . 0.0 111.315 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.414 ' HA ' HD23 ' A' ' 22' ' ' LEU . 13.2 mt -84.72 124.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.741 -175.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.543 ' HG2' ' HD2' ' A' ' 23' ' ' ARG . 0.6 OUTLIER -113.21 -18.92 11.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.849 0.357 . . . . 0.0 110.978 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.708 ' HZ1' ' HB2' ' A' ' 33' ' ' LYS . 3.8 ttmp? -126.38 140.81 52.21 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.0 t-105 -153.68 113.49 3.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.615 0.245 . . . . 0.0 110.624 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -117.79 -1.84 11.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.013 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.506 HD22 ' HB3' ' A' ' 19' ' ' ASP . 88.0 mt -73.91 152.12 40.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.659 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.9 mtt180 -85.88 45.99 1.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.943 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.43 139.75 30.49 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.369 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.12 145.52 67.2 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.411 2.074 . . . . 0.0 111.469 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 40' ' ' LEU . 4.2 mm? -65.7 127.38 93.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.782 -179.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.422 ' HG2' HD23 ' A' ' 46' ' ' LEU . 30.5 Cg_endo -63.68 164.55 20.88 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.875 2.383 . . . . 0.0 112.028 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 p -97.2 172.29 7.9 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.342 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.4 tp60 -50.43 -55.2 16.86 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.093 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.85 77.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.135 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.86 -44.8 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.449 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.422 HD23 ' HG2' ' A' ' 41' ' ' PRO . 92.6 mt -61.55 -43.72 98.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.972 0.415 . . . . 0.0 111.21 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.27 -29.02 64.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.294 -178.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.1 m -62.98 -44.59 95.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.655 177.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.7 m0 -68.17 -37.45 81.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.419 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.568 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 66.4 t-105 -60.89 -49.4 77.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.788 174.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -58.32 -41.8 85.35 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.489 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.413 ' HB3' ' OH ' ' A' ' 9' ' ' TYR . 79.7 mt-10 -62.35 -45.51 92.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.012 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.411 HD13 ' HB2' ' A' ' 9' ' ' TYR . 67.3 tp -60.14 -32.77 71.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.787 0.327 . . . . 0.0 111.052 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.4 mm-40 -81.26 -40.57 23.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.815 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -85.17 -17.88 35.84 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.341 0.591 . . . . 0.0 112.39 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -99.37 143.53 26.6 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.826 -177.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -57.21 138.55 86.74 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.773 2.316 . . . . 0.0 111.223 175.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.84 173.49 11.85 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.439 2.093 . . . . 0.0 112.795 -177.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -49.18 123.42 7.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.606 174.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.123 -176.888 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.521 ' HE1' ' HB2' ' A' ' 50' ' ' TRP . 25.0 ttt . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.658 0.266 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.441 ' N ' HD13 ' A' ' 2' ' ' ILE . 4.1 mp -95.85 106.02 17.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.686 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.4 mm? -71.42 -32.77 68.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.33 -175.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.576 ' HE1' ' HG ' ' A' ' 16' ' ' SER . 87.0 t80 -51.35 -51.8 51.25 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.945 -174.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.85 -46.8 86.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.982 0.42 . . . . 0.0 111.065 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.76 -47.09 86.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.596 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.8 mt -65.83 -42.14 91.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.5 ' HE1' ' HA ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -63.81 -28.69 70.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.432 178.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -71.15 -36.62 72.12 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.963 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.61 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 85.1 tttt -86.85 -36.75 18.28 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.239 -179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -129.55 88.96 48.44 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.787 0.327 . . . . 0.0 111.054 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.5 ' HA ' ' HE1' ' A' ' 8' ' ' MET . 73.0 Cg_endo -77.24 -21.35 11.97 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.709 2.272 . . . . 0.0 113.146 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.56 5.99 45.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.428 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.22 147.1 23.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.522 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 38.9 t -95.32 128.29 46.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.019 0.438 . . . . 0.0 111.058 -176.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.576 ' HG ' ' HE1' ' A' ' 4' ' ' TYR . 6.6 m -61.68 138.54 58.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.812 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.51 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 0.7 OUTLIER 69.95 -3.82 1.64 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.571 0.748 . . . . 0.0 111.92 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.522 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 61.6 tttp -112.17 -61.12 1.76 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.777 0.322 . . . . 0.0 110.426 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.422 ' HB3' HD22 ' A' ' 36' ' ' LEU . 28.6 m-20 -85.91 -37.17 19.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.379 0.609 . . . . 0.0 109.974 177.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -134.07 114.42 13.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.947 173.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 43.7 tt0 -96.54 141.56 29.68 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.488 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.425 HD12 ' CD1' ' A' ' 4' ' ' TYR . 44.1 mt -107.59 153.3 23.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.097 0.475 . . . . 0.0 111.589 -172.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.579 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 29.7 ttt180 -132.65 122.35 24.54 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.826 174.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.418 ' HA ' ' HA ' ' A' ' 29' ' ' SER . 47.5 t30 -97.19 116.02 28.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.186 0.517 . . . . 0.0 110.675 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -95.56 -11.62 27.05 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.557 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.52 -47.26 1.07 Allowed Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 -174.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -71.49 -17.39 62.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.732 0.777 . . . . 0.0 109.794 174.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 164.95 161.75 14.56 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.999 178.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 24' ' ' ASN . 19.7 m -99.76 108.72 21.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.686 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 43.0 p90 -111.71 -168.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.685 0.279 . . . . 0.0 111.117 -176.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -76.54 122.99 32.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.087 0.47 . . . . 0.0 111.833 -174.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.579 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 9.2 tp10 -96.06 -61.67 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.157 172.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.647 ' HB2' ' HZ2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -119.98 119.04 32.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.115 -176.526 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -99.55 111.07 23.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -115.51 11.32 15.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.49 0.662 . . . . 0.0 110.1 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' A' ' 19' ' ' ASP . 84.2 mt -89.73 140.03 29.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -82.65 44.93 0.93 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.476 0.655 . . . . 0.0 110.351 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.05 147.3 65.29 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.417 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -55.5 145.15 70.39 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 123.016 2.477 . . . . 0.0 112.654 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.74 125.02 85.43 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.155 177.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -58.58 147.35 87.28 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.912 2.408 . . . . 0.0 113.087 -178.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.409 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.7 p -83.49 157.98 22.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.208 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.482 HE21 ' HG3' ' A' ' 47' ' ' GLU . 16.8 tp60 -57.43 -42.85 83.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.12 0.486 . . . . 0.0 110.296 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.49 -51.85 66.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.412 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.69 -42.45 98.01 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.662 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.453 HD22 HD11 ' A' ' 3' ' ' LEU . 90.5 mt -54.26 -53.52 52.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.198 177.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.482 ' HG3' HE21 ' A' ' 43' ' ' GLN . 46.4 mt-10 -71.22 -18.99 62.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.627 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 95.0 m -70.97 -46.69 61.9 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 174.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.61 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.7 m0 -61.5 -40.72 95.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.995 0.426 . . . . 0.0 109.876 177.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.521 ' HB2' ' HE1' ' A' ' 1' ' ' MET . 75.1 t-105 -60.11 -44.38 94.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.376 176.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -60.53 -49.48 77.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.457 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -63.68 -35.69 81.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.727 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.538 ' HA ' ' HD3' ' A' ' 57' ' ' PRO . 36.1 tp -63.99 -45.7 87.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.643 175.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -69.75 -27.97 65.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.024 0.44 . . . . 0.0 111.185 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -84.4 1.28 46.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.1 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.5 t30 63.45 99.0 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.337 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.012 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.538 ' HD3' ' HA ' ' A' ' 53' ' ' LEU . 76.0 Cg_endo -79.42 147.43 20.16 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.826 2.351 . . . . 0.0 112.074 -178.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.01 154.06 52.63 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.283 1.989 . . . . 0.0 112.292 178.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -70.84 132.87 45.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.573 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 C--N 1.33 -0.27 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 -179.641 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 120.576 0.227 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 30.4 mm -88.57 107.06 17.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 110.331 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.712 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.1 mm? -70.13 -35.57 74.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.873 0.368 . . . . 0.0 110.789 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.479 ' HB2' HD12 ' A' ' 22' ' ' LEU . 71.3 t80 -52.46 -50.65 62.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.924 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.462 ' OD1' HD11 ' A' ' 53' ' ' LEU . 0.7 OUTLIER -65.83 -38.36 88.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -174.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.54 -44.29 78.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.018 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 3' ' ' LEU . 87.9 mt -61.65 -49.21 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.427 179.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -69.56 -22.73 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.84 -177.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -67.66 -41.98 82.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -92.01 -40.11 11.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.255 -178.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -119.26 97.05 50.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.097 -176.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -74.61 -13.66 22.3 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.555 2.17 . . . . 0.0 111.419 175.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -87.4 2.2 51.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.414 ' HB2' ' CE1' ' A' ' 20' ' ' PHE . . . -87.3 105.35 17.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.958 0.409 . . . . 0.0 110.815 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.1 t -81.9 117.74 28.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.774 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m -69.36 149.87 47.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.578 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 64.83 22.41 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.525 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -146.06 -72.36 0.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.084 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.539 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 4.4 m-20 -80.41 -17.42 51.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.356 0.598 . . . . 0.0 110.429 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 14' ' ' ALA . 40.3 p90 -160.07 144.81 14.79 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.092 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -118.91 131.21 56.04 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.729 0.3 . . . . 0.0 110.196 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.479 HD12 ' HB2' ' A' ' 4' ' ' TYR . 29.0 mt -102.77 153.35 20.25 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.436 ' O ' ' HA ' ' A' ' 29' ' ' SER . 4.1 mtt180 -137.4 148.24 46.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.675 174.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -89.33 126.88 35.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.222 -174.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.72 -13.07 16.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.54 -33.72 6.15 Favored Glycine 0 N--CA 1.453 -0.216 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -172.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -87.93 2.45 51.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.07 0.938 . . . . 0.0 109.1 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 130.86 176.12 14.29 Favored Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.449 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 19.3 m -104.69 122.5 45.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.767 0.317 . . . . 0.0 110.269 177.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.712 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 2.9 p90 -120.61 -179.75 4.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.353 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.83 120.68 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.416 -173.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -94.09 -58.33 2.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.165 0.507 . . . . 0.0 109.707 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -115.67 145.88 42.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.973 -178.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.2 t-105 -128.02 111.93 14.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.114 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -113.7 -2.83 13.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 -179.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.539 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 34.7 mt -66.02 140.75 58.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -84.85 39.53 0.76 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.683 0.754 . . . . 0.0 110.197 178.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -123.36 154.71 65.81 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.961 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -69.48 151.41 70.69 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.082 1.855 . . . . 0.0 112.222 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.24 116.66 49.24 Favored Pre-proline 0 N--CA 1.45 -0.467 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.17 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -65.32 159.58 46.61 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.513 2.142 . . . . 0.0 112.224 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.2 p -92.29 167.58 11.91 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.45 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -55.5 -45.98 77.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.154 0.502 . . . . 0.0 110.005 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.84 91.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.178 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.3 -43.68 96.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.075 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.5 mt -60.17 -46.93 88.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.181 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -68.89 -24.44 64.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.338 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.9 m -63.68 -50.8 67.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.814 0.34 . . . . 0.0 110.779 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 8.8 m0 -70.46 -32.16 69.6 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.181 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -64.93 -41.85 95.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.783 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.38 -51.08 71.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.194 175.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -63.96 -30.84 71.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.071 0.462 . . . . 0.0 111.231 -178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.462 HD11 ' OD1' ' A' ' 5' ' ' ASP . 6.6 tt -65.93 -38.25 88.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.154 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.74 -32.58 20.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.552 -178.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.99 -15.62 58.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.379 0.609 . . . . 0.0 110.578 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -139.77 87.94 12.54 Favored Pre-proline 0 C--N 1.315 -0.911 0 CA-C-N 115.013 -0.994 . . . . 0.0 108.854 171.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.441 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 19.9 Cg_endo -60.34 145.2 99.11 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.27 2.646 . . . . 0.0 113.029 -173.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 24.6 Cg_exo -63.94 167.92 13.1 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 123.021 2.481 . . . . 0.0 111.782 176.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -109.73 121.04 44.31 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.376 -177.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.227 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 2' ' ' ILE . 4.1 mp -74.0 106.35 3.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.484 ' O ' HG13 ' A' ' 7' ' ' ILE . 2.5 mm? -64.49 -34.96 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.731 -173.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -51.23 -47.02 62.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.479 -175.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -68.87 -51.23 42.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.986 0.422 . . . . 0.0 110.884 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.1 -45.74 83.16 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.058 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.8 mt -65.69 -41.91 91.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -177.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 61.0 mtp -72.84 -19.14 61.37 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.101 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -74.65 -33.58 62.55 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 173.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -75.97 -54.45 6.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.679 178.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -120.69 91.95 47.58 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -63.43 -24.37 71.0 Favored 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.733 2.289 . . . . 0.0 112.817 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -93.76 10.67 32.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.809 0.338 . . . . 0.0 111.634 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -92.43 127.75 38.04 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.1 t -96.7 117.58 41.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-O 121.019 0.438 . . . . 0.0 111.192 -176.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -67.19 142.44 56.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 67.23 22.6 9.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.651 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -140.68 -69.41 0.39 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.065 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -93.35 -34.96 13.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.363 0.601 . . . . 0.0 109.609 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -130.47 132.27 45.58 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 170.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.598 ' HB2' ' HB3' ' A' ' 33' ' ' LYS . 49.0 mt-10 -114.19 127.8 56.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 121.265 0.555 . . . . 0.0 111.013 -175.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.454 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 25.5 mt -109.43 149.71 29.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.432 178.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.514 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mpt_? -130.7 164.66 24.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.903 0.382 . . . . 0.0 110.756 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -82.7 125.0 30.74 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.938 -174.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.416 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 15.8 t70 -91.1 -52.3 4.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.423 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 154.09 -35.32 0.72 Allowed Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.206 -176.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -121.4 34.45 5.19 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.83 179.78 17.11 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.788 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.8 m -113.21 137.53 51.33 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.416 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 21.7 p90 -121.6 175.57 6.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.727 0.299 . . . . 0.0 111.029 -176.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.471 HG13 ' HG ' ' A' ' 3' ' ' LEU . 39.9 mt -81.74 122.46 36.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.91 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.514 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -116.84 -33.05 4.91 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.569 175.324 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.598 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -124.18 133.08 53.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.55 0.214 . . . . 0.0 110.428 -179.019 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -134.34 109.49 8.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -108.25 -1.56 20.05 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.913 0.387 . . . . 0.0 110.711 -176.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.19 143.87 56.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.672 175.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -90.25 34.34 0.87 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.475 0.655 . . . . 0.0 109.949 -179.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -125.02 144.65 47.78 Favored Pre-proline 0 C--N 1.316 -0.888 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.739 -178.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -61.0 150.88 81.97 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.688 2.259 . . . . 0.0 112.287 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -66.41 139.76 96.35 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.656 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.97 166.12 19.45 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.846 2.364 . . . . 0.0 112.608 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.471 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 77.8 p -89.02 158.0 18.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.203 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -57.29 -43.58 83.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.281 0.562 . . . . 0.0 109.749 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.38 76.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.742 -1.117 . . . . 0.0 111.584 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.39 -41.35 96.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.745 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 42' ' ' THR . 95.8 mt -51.39 -50.0 60.45 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 111.132 176.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -62.23 -41.83 98.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.735 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.8 m -65.31 -34.69 78.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.378 -177.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -59.97 -45.86 91.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.022 0.439 . . . . 0.0 109.843 175.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 -62.45 -40.57 97.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.265 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.49 -50.29 73.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.069 177.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.06 -43.43 98.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.214 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.97 -36.0 82.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.508 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -34.35 33.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.243 -178.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -86.94 -11.05 51.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -57.23 126.88 75.39 Favored Pre-proline 0 C--N 1.315 -0.909 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.326 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -52.54 156.02 9.22 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.905 2.404 . . . . 0.0 112.38 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -41.95 136.85 3.33 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.857 3.038 . . . . 0.0 113.285 -177.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -70.54 127.79 33.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.396 -177.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 121.307 0.575 . . . . 0.0 110.448 177.988 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.408 HG21 ' H ' ' A' ' 4' ' ' TYR . 3.8 mp -117.72 132.4 67.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.809 -179.156 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.407 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.9 mm? -59.66 -34.47 72.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.919 0.39 . . . . 0.0 111.579 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.408 ' H ' HG21 ' A' ' 2' ' ' ILE . 62.0 t80 -52.95 -53.24 52.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -60.86 -48.16 83.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.264 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.34 -51.0 71.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.614 -178.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 3' ' ' LEU . 75.8 mt -62.39 -42.74 96.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.763 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -24.96 65.51 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.882 -176.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -72.21 -45.22 61.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.878 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.698 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 46.1 tttp -72.94 -49.86 26.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.66 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -115.62 94.8 41.56 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.888 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -67.54 -17.57 48.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.832 2.354 . . . . 0.0 111.814 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -95.85 9.51 40.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.909 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.856 ' HB1' ' HZ ' ' A' ' 20' ' ' PHE . . . -82.01 140.72 33.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.125 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.493 ' C ' ' H ' ' A' ' 17' ' ' ARG . 43.4 t -107.45 87.15 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.167 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 m -83.48 37.81 0.59 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 122.324 1.059 . . . . 0.0 109.581 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.493 ' H ' ' C ' ' A' ' 15' ' ' VAL . 51.9 mtt180 -96.07 -53.96 3.47 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 113.517 -1.674 . . . . 0.0 111.137 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -145.05 -45.78 0.23 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.152 -163.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -61.94 -27.7 69.01 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.723 0.773 . . . . 0.0 109.514 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.856 ' HZ ' ' HB1' ' A' ' 14' ' ' ALA . 35.4 p90 -155.89 149.04 24.48 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.374 167.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -145.04 146.11 31.74 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.301 -170.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 39.0 mt -97.34 151.93 19.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.483 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.3 mpt_? -136.75 168.4 19.6 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.227 175.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -87.58 126.01 34.69 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.454 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 19.9 t70 -102.22 -15.53 16.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.299 0.571 . . . . 0.0 109.99 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.43 -53.34 0.8 Allowed Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.64 10.25 21.26 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.302 0.572 . . . . 0.0 109.924 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 144.18 -170.76 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.234 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.42 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 40.2 m -102.1 123.84 46.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.829 0.347 . . . . 0.0 110.607 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.454 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.2 p90 -122.7 177.81 5.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.355 -176.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.4 mt -75.38 121.05 26.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.226 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.483 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 26.3 tt0 -122.21 -46.08 2.2 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.987 177.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -89.82 131.55 35.71 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -151.2 110.72 3.99 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -175.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -107.11 1.86 24.49 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.525 -175.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.7 mt -91.65 145.93 24.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.453 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 37' ' ' ARG . 58.5 mtt180 -83.22 48.02 1.33 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.757 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.97 145.86 55.48 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.49 -178.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.93 145.16 61.04 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.344 2.03 . . . . 0.0 111.305 174.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.89 134.02 95.93 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.596 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.79 158.95 22.45 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.487 2.791 . . . . 0.0 112.924 -178.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.434 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 59.9 p -88.64 158.68 18.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.078 -175.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -53.64 -44.77 69.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.242 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.11 -51.89 67.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.59 -43.43 96.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.484 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.2 mt -53.93 -47.41 71.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.896 0.379 . . . . 0.0 111.231 178.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -72.53 -29.25 63.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.483 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.9 m -69.33 -41.22 76.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.871 176.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.698 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 37.9 m0 -60.08 -46.09 90.73 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 174.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -57.82 -48.74 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.593 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -56.84 -53.27 59.78 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.563 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -65.72 -30.36 71.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.442 -177.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.0 -38.79 89.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.909 0.385 . . . . 0.0 110.294 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.3 -30.9 38.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.161 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.402 ' O ' ' HD3' ' A' ' 57' ' ' PRO . 45.4 tttt -79.46 -15.5 57.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.682 -178.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -108.65 92.02 9.61 Favored Pre-proline 0 C--N 1.315 -0.933 0 N-CA-C 108.525 -0.916 . . . . 0.0 108.525 173.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 55' ' ' LYS . 31.3 Cg_exo -59.03 123.17 12.9 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.941 2.427 . . . . 0.0 113.018 -172.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.51 143.81 83.02 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.569 2.179 . . . . 0.0 110.812 174.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -99.19 148.18 24.36 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -174.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 C--N 1.323 -0.546 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.079 177.248 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.405 ' N ' HD13 ' A' ' 2' ' ' ILE . 4.3 mp -97.51 112.7 30.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.206 0.527 . . . . 0.0 110.446 -178.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD11 HD13 ' A' ' 46' ' ' LEU . 2.4 mm? -65.71 -33.35 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.035 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -52.37 -54.18 35.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.907 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.91 -44.67 96.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.337 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.68 -51.41 69.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.421 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 3' ' ' LEU . 71.5 mt -64.56 -41.62 92.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.607 0.241 . . . . 0.0 110.745 -178.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.485 ' HE1' ' HA ' ' A' ' 8' ' ' MET . 0.1 OUTLIER -69.59 -13.95 62.59 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.584 -179.303 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -82.19 -40.24 22.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -76.99 -51.75 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.741 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -118.14 98.17 51.26 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.137 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.15 -31.33 54.54 Favored 'Trans proline' 0 CA--C 1.528 0.211 0 C-N-CA 123.032 2.488 . . . . 0.0 113.123 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -102.61 19.49 18.97 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -176.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.88 119.53 24.52 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.52 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.444 ' C ' ' H ' ' A' ' 17' ' ' ARG . 47.5 t -84.7 88.55 2.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.548 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.467 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 9.9 p -85.89 36.73 0.68 Allowed 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.459 1.123 . . . . 0.0 110.24 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.444 ' H ' ' C ' ' A' ' 15' ' ' VAL . 93.8 mtt180 -97.29 -60.34 1.6 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 113.629 -1.623 . . . . 0.0 110.988 175.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.5 tttp -128.89 -43.09 1.37 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 111.655 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.614 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 5.6 t70 -65.26 -34.74 79.07 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 16' ' ' SER . 14.1 p90 -143.44 132.08 22.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 164.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -105.13 141.72 36.18 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.744 -169.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.5 mt -113.49 152.71 29.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.687 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -144.91 174.57 10.9 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.126 0.488 . . . . 0.0 109.828 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -129.99 117.53 20.21 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.763 -176.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.92 -27.18 57.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.297 0.57 . . . . 0.0 109.703 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.54 -42.37 1.17 Allowed Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.637 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -99.47 -0.07 41.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.443 0.639 . . . . 0.0 110.644 -176.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 177.22 155.99 14.97 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.226 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.8 m -105.05 122.16 45.29 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -130.84 -179.3 5.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.983 -173.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.3 mt -87.36 132.81 31.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.565 ' HG3' ' HD2' ' A' ' 33' ' ' LYS . 13.1 pt-20 -111.63 -34.01 6.19 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.24 176.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.565 ' HD2' ' HG3' ' A' ' 32' ' ' GLU . 10.1 mptt -126.02 148.71 49.23 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 175.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -144.04 111.61 6.03 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.614 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 90.1 m-20 -123.06 13.66 9.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.704 0.288 . . . . 0.0 110.643 -178.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.0 mt -66.22 153.45 42.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.183 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 37' ' ' ARG . 62.2 mtt180 -82.13 42.35 0.73 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.127 178.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -152.4 154.58 32.16 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.484 -177.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.94 171.1 17.31 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.327 2.018 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -79.51 135.63 56.7 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.794 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.63 173.51 12.45 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.724 2.282 . . . . 0.0 111.819 176.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.603 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 34.2 p -99.11 161.4 13.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.073 -177.306 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.66 -44.76 85.93 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.07 -45.86 89.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.363 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.51 -45.01 95.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.656 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.6 mt -50.89 -50.47 57.13 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.494 0.496 . . . . 0.0 111.476 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -71.28 -28.62 64.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -178.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.9 m -66.03 -38.9 89.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.88 0.371 . . . . 0.0 110.31 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -63.17 -42.98 99.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -61.89 -44.73 96.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.373 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -61.09 -46.98 88.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.427 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -66.98 -28.7 68.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.281 . . . . 0.0 111.372 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.86 -54.8 21.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.842 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.99 -32.41 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.555 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -95.85 27.61 3.46 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -41.32 146.51 0.52 Allowed Pre-proline 0 N--CA 1.469 0.525 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.425 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.07 163.96 32.16 Favored 'Trans proline' 0 C--O 1.236 0.412 0 C-N-CA 122.748 2.299 . . . . 0.0 111.563 175.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.9 157.49 61.54 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.397 2.065 . . . . 0.0 112.073 176.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -125.95 124.13 40.09 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.17 -179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.272 179.872 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.5 mmm . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.649 0.261 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.7 mm -87.53 110.76 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 2.3 mm? -69.22 -38.06 78.35 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.488 -175.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -54.73 -48.69 72.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.525 -176.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.4 -49.88 76.12 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.213 0.321 . . . . 0.0 111.016 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.88 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.587 -178.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.45 -43.55 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.481 ' HA ' ' HE3' ' A' ' 8' ' ' MET . 0.0 OUTLIER -66.84 -23.13 66.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.855 -177.13 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -77.09 -48.61 17.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.194 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.93 -27.72 23.18 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.73 0.3 . . . . 0.0 110.649 -177.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -116.16 83.62 12.83 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -67.15 -28.46 40.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.904 2.403 . . . . 0.0 113.211 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -111.26 27.14 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.659 -174.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.65 141.91 34.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.64 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.524 ' HB ' ' HB2' ' A' ' 19' ' ' ASP . 41.6 t -81.02 103.72 8.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.063 0.458 . . . . 0.0 111.144 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.0 m -69.82 140.29 53.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.234 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.1 mtt-85 71.12 11.96 6.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.556 173.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -140.4 -59.66 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.796 0.331 . . . . 0.0 110.452 173.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.524 ' HB2' ' HB ' ' A' ' 15' ' ' VAL . 0.5 OUTLIER -76.39 -26.31 55.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.265 0.555 . . . . 0.0 110.024 176.955 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -142.25 114.4 8.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 166.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -94.14 136.12 34.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.582 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.3 mt -105.86 152.79 22.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.626 -175.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.826 HH11 ' HG2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -139.74 155.51 47.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.366 174.236 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -88.35 109.6 20.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.882 -178.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.527 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 28.1 t70 -84.82 -42.84 14.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.08 0.467 . . . . 0.0 111.205 -178.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.37 -39.09 0.93 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.675 -177.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -107.19 27.84 8.65 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.62 179.52 15.81 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.124 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 m -90.99 131.31 36.67 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.557 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 1.7 p90 -125.94 -177.95 4.12 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.0 mt -74.67 121.54 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.091 0.472 . . . . 0.0 111.449 -175.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.826 ' HG2' HH11 ' A' ' 23' ' ' ARG . 3.7 tp10 -100.22 -52.66 3.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 176.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -129.56 111.36 12.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.557 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -100.89 112.41 24.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 -177.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.444 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 80.6 m-20 -114.63 -6.12 12.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.621 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 36.5 mt -65.54 137.73 57.59 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.482 0.658 . . . . 0.0 111.278 -178.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -83.27 36.18 0.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.926 0.87 . . . . 0.0 109.901 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 36' ' ' LEU . . . -125.08 147.48 57.15 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.458 -1.247 . . . . 0.0 109.751 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.08 144.61 94.6 Favored 'Trans proline' 0 C--O 1.238 0.525 0 C-N-CA 123.023 2.482 . . . . 0.0 113.011 178.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.31 126.86 92.79 Favored Pre-proline 0 N--CA 1.45 -0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.33 176.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.69 150.83 59.29 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.019 2.479 . . . . 0.0 112.564 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 p -102.72 168.6 9.14 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.896 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -56.59 -54.57 44.48 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.938 -178.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.98 85.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.027 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.574 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 34.0 mt-10 -57.44 -54.34 47.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.982 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.5 mt -51.68 -49.39 62.48 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.585 -178.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.19 -31.86 68.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.649 -177.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.2 m -67.36 -44.33 79.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.901 178.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.574 ' CZ2' ' HB3' ' A' ' 45' ' ' GLU . 15.5 m0 -64.18 -39.49 94.12 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.58 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -60.31 -49.14 78.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.173 176.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -62.36 -43.89 97.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.717 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.98 -36.55 83.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.239 -0.184 . . . . 0.0 110.742 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -64.18 -39.91 94.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.806 0.336 . . . . 0.0 110.504 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.58 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 26.9 mm-40 -66.9 -37.18 83.89 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.424 0.631 . . . . 0.0 109.963 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -86.97 5.63 36.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.043 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -99.93 138.86 20.42 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.19 -176.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -61.6 133.42 45.44 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.917 2.411 . . . . 0.0 111.805 174.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -53.01 141.2 57.71 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.976 2.451 . . . . 0.0 113.224 -176.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -80.12 124.66 28.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.48 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 . . . . . 0 C--N 1.327 -0.391 0 O-C-N 123.427 0.454 . . . . 0.0 110.324 178.866 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.6 0.238 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 59.2 mt -119.39 128.76 75.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.482 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.8 mm? -67.19 -37.58 83.92 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.248 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -52.44 -46.61 66.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.471 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.65 -47.31 85.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.828 0.347 . . . . 0.0 111.12 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.4 95.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.397 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.7 mt -63.37 -40.74 90.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.63 179.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.9 mmt -68.46 -21.93 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.74 0.305 . . . . 0.0 111.313 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -74.67 -43.44 55.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 0.0 110.541 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -90.81 -35.33 14.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.687 -175.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -121.6 84.55 42.81 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.542 0.21 . . . . 0.0 111.253 -176.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -70.9 -22.9 26.25 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.895 2.397 . . . . 0.0 112.782 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -95.94 8.36 43.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.452 -176.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.99 139.89 31.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.2 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 t -106.16 127.6 61.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 CA-C-O 121.118 0.485 . . . . 0.0 111.108 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.7 p -73.09 152.67 41.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.034 176.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.1 mtm180 65.25 17.04 10.86 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.208 0.527 . . . . 0.0 109.96 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -141.58 -73.73 0.32 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.468 -174.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.406 ' HB3' HD21 ' A' ' 36' ' ' LEU . 53.9 m-20 -80.34 -29.71 38.0 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.453 0.644 . . . . 0.0 109.857 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -139.93 136.18 33.58 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.918 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.712 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 5.8 tp10 -96.61 127.24 42.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.273 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.7 mt -100.69 153.46 19.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.977 0.417 . . . . 0.0 110.126 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -129.71 142.2 50.75 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -94.73 109.99 21.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.114 0.483 . . . . 0.0 110.878 -176.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -79.02 -39.2 34.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.399 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.19 -42.22 1.64 Allowed Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -173.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -89.13 -5.89 57.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.856 0.836 . . . . 0.0 109.024 173.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 167.93 -177.89 41.98 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.44 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 21.3 m -120.34 130.59 54.49 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.4 p90 -124.4 -179.77 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.248 0.343 . . . . 0.0 111.231 -176.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.7 mt -84.85 121.41 36.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.365 0.602 . . . . 0.0 111.466 -173.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -96.9 -58.29 2.07 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.296 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.712 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 9.7 ttmm -113.58 138.67 49.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.206 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -125.83 112.16 15.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -116.31 11.03 14.93 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.901 0.381 . . . . 0.0 111.41 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 19' ' ' ASP . 66.6 mt -87.69 144.29 26.73 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.901 0.382 . . . . 0.0 111.124 -178.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -81.5 62.88 5.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.43 0.633 . . . . 0.0 109.811 174.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.22 143.65 19.69 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.577 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.31 146.89 93.34 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.578 2.185 . . . . 0.0 111.817 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.82 118.91 62.46 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.342 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.18 146.02 97.22 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.692 2.262 . . . . 0.0 112.548 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 9.2 p -93.82 171.75 8.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.738 -177.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -53.78 -51.69 62.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.694 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.08 -42.56 76.89 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.276 178.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -50.02 72.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.957 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.9 mt -58.05 -44.48 87.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.682 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 42.6 mt-10 -65.13 -44.06 89.88 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.103 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -59.06 -43.67 91.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -61.28 -40.74 95.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.355 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.0 t-105 -66.29 -44.08 84.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.123 177.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 64.5 mt-10 -61.28 -42.4 98.59 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.887 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.34 -30.81 62.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.767 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.4 tp -77.57 -40.01 43.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.01 0.433 . . . . 0.0 111.025 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -83.47 -23.22 32.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -86.99 -16.02 36.98 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.361 0.6 . . . . 0.0 110.385 176.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 . . . . . 0 C--N 1.316 -0.875 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.309 -179.672 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.436 ' SD ' ' HG2' ' A' ' 47' ' ' GLU . 18.0 ptt? . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.054 0.454 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.67 125.76 73.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.549 HD11 HD13 ' A' ' 46' ' ' LEU . 4.0 mm? -61.04 -40.29 93.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.7 -176.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.574 ' HB2' HD11 ' A' ' 22' ' ' LEU . 15.1 t80 -55.2 -51.68 65.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.222 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -60.76 -46.86 88.83 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.369 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.85 84.15 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.337 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.5 HD11 HD11 ' A' ' 31' ' ' ILE . 70.3 mt -67.27 -45.55 85.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 -179.471 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.2 mmt -65.96 -27.83 68.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.618 -176.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -75.95 -42.21 49.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.028 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.56 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 9.4 tmtt? -84.49 -36.57 22.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.827 -176.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.56 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 92.4 m-85 -127.62 88.23 54.08 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.008 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.84 -20.53 17.16 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.684 2.256 . . . . 0.0 112.266 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -86.24 5.59 33.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.892 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.65 129.67 37.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.2 t -90.37 110.28 21.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.35 0.595 . . . . 0.0 111.405 -175.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 20' ' ' PHE . 22.1 p -79.85 162.06 25.26 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 63.57 23.04 13.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.595 0.712 . . . . 0.0 110.116 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -145.89 -68.21 0.28 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.788 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.586 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 27.2 m-20 -88.93 -52.78 4.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.392 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.662 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 41.3 p90 -117.62 130.2 56.23 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.315 0.578 . . . . 0.0 111.411 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.767 ' HB2' ' HB2' ' A' ' 33' ' ' LYS . 2.0 mp0 -129.6 161.69 29.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.228 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 4' ' ' TYR . 46.5 mt -96.57 154.38 17.31 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.621 0.724 . . . . 0.0 111.971 -173.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.613 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 1.8 tpt180 -134.24 156.37 48.52 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -89.89 120.68 31.32 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.515 -0.474 . . . . 0.0 111.115 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.611 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 23.3 t70 -92.27 -23.93 19.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.923 177.097 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.8 -47.97 0.99 Allowed Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.201 -175.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.585 0.707 . . . . 0.0 109.869 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 169.43 -179.87 41.71 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.596 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 m -98.29 119.27 36.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.611 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 24.6 p90 -110.04 -179.44 3.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.842 0.353 . . . . 0.0 111.034 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.5 HD11 HD11 ' A' ' 7' ' ' ILE . 35.3 mt -91.03 123.01 43.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.797 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.613 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 2.1 tm-20 -119.93 -52.99 2.19 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.767 ' HB2' ' HB2' ' A' ' 21' ' ' GLU . 2.7 mmmp? -78.6 113.67 16.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.634 173.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -134.76 110.34 9.15 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.586 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 2.1 m-20 -118.91 4.17 11.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.196 -178.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.3 mt -73.78 141.23 46.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.072 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -79.96 46.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.341 0.591 . . . . 0.0 110.803 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.48 145.82 30.28 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.881 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.24 155.21 51.72 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.653 2.235 . . . . 0.0 112.441 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.0 mm? -71.66 137.08 83.02 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.161 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.529 ' HG2' HD21 ' A' ' 46' ' ' LEU . 74.4 Cg_endo -76.25 -177.91 4.03 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.078 2.518 . . . . 0.0 112.098 175.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.457 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 40.5 p -98.64 164.82 12.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.935 -177.041 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.423 ' HA ' HD12 ' A' ' 46' ' ' LEU . 5.8 tt0 -60.44 -46.03 91.51 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 110.038 -178.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.43 -48.09 74.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -56.95 -51.22 70.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.257 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.549 HD13 HD11 ' A' ' 3' ' ' LEU . 68.2 mt -54.88 -50.82 67.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.438 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 48.2 mt-10 -66.75 -33.35 75.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.509 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.9 m -65.87 -37.9 87.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.539 0.209 . . . . 0.0 110.705 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.472 ' CE2' ' HG3' ' A' ' 10' ' ' LYS . 22.1 m0 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.715 0.293 . . . . 0.0 110.244 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -60.92 -44.55 97.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.205 0.526 . . . . 0.0 110.03 173.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.9 mt-10 -61.38 -46.66 89.28 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.14 177.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 51.7 mt-10 -63.33 -42.28 98.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.855 178.076 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.1 tp -57.87 -43.94 86.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.916 0.389 . . . . 0.0 111.191 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -75.56 -33.12 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.908 -174.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 48.0 tttm -84.59 -7.48 59.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.04 0.448 . . . . 0.0 111.577 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 5.0 t30 . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.768 -174.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.483 1.218 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.439 ' H ' HD12 ' A' ' 2' ' ' ILE . 4.3 mp -78.87 104.42 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.484 0.659 . . . . 0.0 110.434 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -71.12 -31.92 68.36 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.265 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -51.04 -53.89 29.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.378 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.417 ' HB3' HD21 ' A' ' 53' ' ' LEU . 1.8 m-20 -64.52 -42.4 95.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.472 -178.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB1' ' HB3' ' A' ' 49' ' ' TRP . . . -59.87 -44.22 94.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.724 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 3' ' ' LEU . 83.5 mt -61.84 -42.17 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.579 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.4 mmt -66.34 -22.88 66.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.957 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -71.93 -45.99 59.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -87.75 -42.45 12.6 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.282 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -117.84 86.96 25.93 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 116.66 -0.245 . . . . 0.0 110.788 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.64 -26.84 22.99 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.742 2.295 . . . . 0.0 112.825 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -91.33 12.13 21.44 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.83 132.71 40.81 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 176.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.0 t -101.56 127.15 55.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.9 m -67.22 141.85 57.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.044 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ttm-85 61.79 22.77 13.26 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.917 0.887 . . . . 0.0 111.225 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -135.0 -62.21 0.73 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.264 172.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.461 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 47.0 m-20 -89.93 -27.68 19.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.051 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -152.06 144.36 24.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.807 177.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 39.8 tt0 -126.6 136.17 52.19 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 mt -89.83 154.08 20.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.939 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 32' ' ' GLU . 9.3 tpp180 -136.45 153.35 51.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.582 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -87.07 112.39 21.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.895 0.378 . . . . 0.0 110.354 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.538 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 19.4 t70 -82.51 -21.07 35.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.488 0.661 . . . . 0.0 110.262 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.12 -41.06 2.34 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -170.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -78.59 -6.46 55.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.062 -0.569 . . . . 0.0 110.444 173.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 143.07 -171.79 24.82 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.132 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.549 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.0 m -95.73 111.25 23.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.538 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -123.9 -176.39 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.905 -177.068 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.8 mt -81.12 131.56 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.863 0.363 . . . . 0.0 111.158 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 23' ' ' ARG . 12.8 tt0 -125.63 -58.95 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.572 173.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 7.5 tmtm? -87.65 125.97 34.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.389 -175.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -134.9 115.74 13.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.653 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -112.59 1.2 15.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.747 -176.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.461 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 77.7 mt -90.77 154.75 19.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -175.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -85.94 43.21 1.03 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -119.84 143.07 34.34 Favored Pre-proline 0 C--N 1.315 -0.897 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.226 -175.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.48 142.49 72.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.485 2.123 . . . . 0.0 112.283 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -76.35 125.31 87.81 Favored Pre-proline 0 N--CA 1.447 -0.609 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.532 ' HG3' ' CH2' ' A' ' 49' ' ' TRP . 33.9 Cg_endo -63.92 158.56 46.59 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 123.143 2.562 . . . . 0.0 112.386 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.432 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 60.5 p -81.62 169.73 16.69 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.454 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -60.34 -43.77 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.65 71.48 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -61.38 -45.25 95.16 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.768 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.493 HD22 HD11 ' A' ' 3' ' ' LEU . 88.1 mt -52.79 -48.8 66.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.594 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.21 -30.36 68.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.776 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.4 m -66.54 -38.14 86.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.417 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.532 ' CH2' ' HG3' ' A' ' 41' ' ' PRO . 46.4 m0 -56.42 -51.39 68.57 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.059 0.457 . . . . 0.0 109.855 175.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -59.21 -46.63 87.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.609 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.02 -46.45 90.7 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.673 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.34 -39.22 93.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.914 0.388 . . . . 0.0 110.815 178.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 5' ' ' ASP . 52.0 tp -64.79 -44.09 91.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.16 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -73.94 -32.8 63.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.0 -177.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.6 tttm -90.29 -3.37 57.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.729 0.3 . . . . 0.0 111.787 -173.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.817 -179.018 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.855 0.359 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.65 120.39 64.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.56 -0.534 . . . . 0.0 109.56 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.531 HD11 HD22 ' A' ' 46' ' ' LEU . 2.4 mm? -70.38 -34.02 72.09 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.1 -47.43 65.26 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.416 0.447 . . . . 0.0 110.925 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.415 ' HB2' ' HZ3' ' A' ' 50' ' ' TRP . 4.5 m-20 -67.81 -48.06 67.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.155 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.15 78.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.737 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 84.2 mt -62.38 -45.53 98.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.73 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.1 ttm -73.98 -24.41 59.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.294 -175.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -65.45 -43.0 91.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 174.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -79.38 -44.3 21.77 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.571 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -122.6 92.85 48.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.354 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.18 -24.24 38.44 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.905 2.404 . . . . 0.0 112.637 -177.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -94.27 10.1 35.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.603 0.716 . . . . 0.0 110.359 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.431 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -80.51 95.36 6.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.455 174.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.2 t -77.92 110.31 13.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.48 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 18.3 m -64.99 153.55 40.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.988 176.277 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 17' ' ' ARG . 58.8 mtt180 75.33 -33.9 0.24 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.558 0.743 . . . . 0.0 111.004 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 16' ' ' SER . 42.4 tptt -80.02 -59.99 2.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.133 0.492 . . . . 0.0 110.255 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.603 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 11.7 t70 -100.25 -48.03 4.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.205 -176.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.431 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 29.8 p90 -131.08 143.83 50.97 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.198 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.433 ' H ' ' HB3' ' A' ' 33' ' ' LYS . 45.5 tt0 -129.86 132.99 46.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.44 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 36.2 mt -99.91 154.23 18.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.082 0.468 . . . . 0.0 111.38 -173.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.483 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -124.16 162.68 23.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.455 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -101.82 106.73 17.75 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.34 -40.95 22.77 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.3 -173.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.4 -58.6 0.16 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.539 -0.838 . . . . 0.0 112.417 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -94.2 -5.99 45.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.88 0.371 . . . . 0.0 111.225 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 176.53 179.56 47.02 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.048 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 10.4 p -105.7 132.45 51.82 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.452 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 52.6 p90 -146.13 -173.59 4.21 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.905 0.384 . . . . 0.0 111.458 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.44 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 23.6 mt -62.15 127.48 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.411 -170.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.483 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 10.2 tp10 -118.66 -58.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 172.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.26 126.95 43.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.12 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -139.7 111.58 7.39 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.95 -11.21 15.37 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.57 -0.452 . . . . 0.0 112.15 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.603 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 60.0 mt -55.3 133.36 49.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.149 0.5 . . . . 0.0 110.896 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 37' ' ' ARG . 54.9 mtt180 -80.12 61.05 3.84 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.532 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.38 141.4 16.32 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.497 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.01 137.16 75.73 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 123.068 2.512 . . . . 0.0 112.204 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.436 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 4.4 mm? -57.74 122.58 57.74 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.231 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 40' ' ' LEU . 18.5 Cg_endo -60.13 158.77 28.78 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.995 2.463 . . . . 0.0 112.234 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.587 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 27.5 p -99.81 162.69 12.84 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -51.79 -49.53 62.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.567 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.43 -46.82 83.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.028 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.97 -44.6 94.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.255 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 42' ' ' THR . 82.7 mt -58.47 -46.16 87.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.476 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.81 -34.85 76.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.755 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.415 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 58.8 m -62.57 -42.93 99.85 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.852 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.401 ' CH2' ' HB3' ' A' ' 41' ' ' PRO . 41.0 m0 -65.8 -37.11 85.38 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.952 0.406 . . . . 0.0 110.323 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.415 ' HZ3' ' HB2' ' A' ' 5' ' ' ASP . 68.6 t-105 -62.65 -45.51 92.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.005 174.042 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.54 -36.84 85.0 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.691 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 48' ' ' THR . 43.3 mt-10 -59.6 -46.53 88.69 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.126 174.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.13 -47.3 85.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.949 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -64.82 -28.31 69.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.227 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -95.56 2.51 54.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.99 0.424 . . . . 0.0 110.798 -178.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 . . . . . 0 C--N 1.322 -0.615 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.169 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.863 0.363 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.69 HG23 ' HB2' ' A' ' 29' ' ' SER . 2.9 mp -90.86 122.79 42.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.014 0.435 . . . . 0.0 110.253 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.438 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.2 mm? -61.83 -30.87 71.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.129 -176.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -51.23 -45.73 62.03 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.173 -177.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -63.45 -49.58 73.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.987 0.423 . . . . 0.0 111.191 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.405 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -59.98 -46.25 90.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.515 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -63.34 -41.77 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.15 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.436 ' HA ' ' CE ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -64.37 -29.0 70.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.944 -178.207 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -76.02 -38.17 57.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.804 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.476 ' HD3' ' CE2' ' A' ' 49' ' ' TRP . 42.8 tptt -76.17 -45.46 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.81 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -126.47 83.94 63.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.218 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.58 -21.39 46.02 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.735 2.29 . . . . 0.0 112.091 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.14 4.72 47.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.638 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -98.9 138.24 36.3 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -96.83 121.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-O 120.981 0.42 . . . . 0.0 111.018 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 138.62 58.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.689 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 69.0 13.73 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.615 0.572 . . . . 0.0 111.316 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HG3' ' OD1' ' A' ' 19' ' ' ASP . 24.2 tptp -116.26 -72.82 0.67 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.405 177.37 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.495 ' OD1' ' HG3' ' A' ' 18' ' ' LYS . 3.0 m-20 -101.77 -1.05 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.301 0.572 . . . . 0.0 110.924 -179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -148.2 124.03 10.59 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 169.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.896 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 34.2 tt0 -110.65 126.57 54.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.126 -176.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.569 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 29.8 mt -103.75 152.86 21.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.996 -173.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.569 ' HD2' ' O ' ' A' ' 22' ' ' LEU . 2.3 mpt_? -133.94 174.59 10.31 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.502 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -89.46 122.17 32.4 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.178 178.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.27 -38.77 26.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.356 0.598 . . . . 0.0 110.206 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.49 -56.99 0.47 Allowed Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.866 -176.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -97.8 -11.0 23.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.557 0.694 . . . . 0.0 109.903 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -168.23 -166.53 27.45 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.71 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.69 ' HB2' HG23 ' A' ' 2' ' ' ILE . 42.3 m -102.39 141.83 34.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.647 0.224 . . . . 0.0 110.514 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.54 177.99 7.39 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 45.1 mt -84.66 131.43 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.624 -177.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.46 -55.24 2.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.164 0.507 . . . . 0.0 109.812 174.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.896 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 4.8 ttmp? -109.91 110.18 21.05 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.382 -176.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -105.33 112.81 26.06 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -118.06 6.06 12.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.184 0.516 . . . . 0.0 110.565 -174.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 57.4 mt -81.28 149.23 29.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.9 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -83.13 40.08 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.362 0.601 . . . . 0.0 110.7 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -128.7 152.78 79.3 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.642 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.33 156.06 67.02 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.317 2.012 . . . . 0.0 111.994 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -71.91 125.32 91.61 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.417 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 23.8 Cg_endo -61.71 159.38 33.07 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.99 2.46 . . . . 0.0 112.599 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.598 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 61.7 p -94.64 156.14 16.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.28 -178.192 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.0 tm0? -52.41 -45.27 65.82 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.71 0.631 . . . . 0.0 109.832 177.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.2 -51.77 68.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.608 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.7 -34.71 78.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.132 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.4 mt -54.34 -46.54 72.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.88 -26.65 59.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.2 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.8 m -63.89 -46.99 82.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.264 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.476 ' CE2' ' HD3' ' A' ' 10' ' ' LYS . 13.6 m0 -63.78 -35.45 80.65 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.08 0.467 . . . . 0.0 109.782 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -60.96 -49.22 78.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.595 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -64.11 -38.83 92.47 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.666 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.66 -48.82 77.67 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.914 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.9 tp -60.54 -22.22 63.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.128 0.49 . . . . 0.0 110.833 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -86.78 -46.14 10.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.231 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.84 -17.08 42.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 54.2 t30 . . . . . 0 C--N 1.311 -1.098 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.844 -173.472 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 ppp? . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.5 mp -112.88 128.77 69.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.13 -179.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.7 mm? -67.59 -40.52 84.79 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.791 0.329 . . . . 0.0 111.376 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.523 ' CD1' HD11 ' A' ' 22' ' ' LEU . 40.4 t80 -52.62 -47.29 67.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.995 -176.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.53 -44.61 93.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.534 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.519 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -64.58 -45.82 85.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.787 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.6 mt -58.86 -48.26 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.69 178.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -26.38 68.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.846 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -69.2 -49.69 54.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.321 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.654 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 86.1 tttt -77.8 -35.76 51.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.996 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -117.8 79.84 13.6 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.852 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.445 ' HD3' ' O ' ' A' ' 10' ' ' LYS . 3.4 Cg_exo -78.38 -23.3 8.81 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.964 2.443 . . . . 0.0 112.066 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -85.19 -6.48 59.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.76 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.4 127.93 34.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.521 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.8 t -82.7 121.13 35.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.093 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.3 t -69.0 143.25 54.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.191 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HA ' ' HG2' ' A' ' 21' ' ' GLU . 81.5 mtt180 63.14 21.43 12.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.964 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -109.29 -69.64 0.85 Allowed 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.418 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -99.43 -46.21 5.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.468 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 32.8 p90 -100.68 138.16 38.12 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 175.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.463 ' CB ' ' HB3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -131.1 142.53 50.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.041 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.523 HD11 ' CD1' ' A' ' 4' ' ' TYR . 14.0 mt -101.71 144.81 29.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.842 -172.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -143.43 169.37 17.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.552 176.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 29' ' ' SER . 10.6 t30 -106.09 112.28 25.26 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.609 -176.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.591 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 30.8 t70 -79.64 -28.37 40.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.803 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 175.84 -95.44 0.1 Allowed Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.484 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -95.91 35.29 1.42 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.483 0.658 . . . . 0.0 109.789 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.77 148.9 7.12 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.97 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 24' ' ' ASN . 16.9 m -99.17 129.05 45.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.591 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -134.78 -168.68 2.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.946 0.403 . . . . 0.0 110.971 -173.114 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -81.96 132.69 30.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.174 177.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -125.23 -53.67 1.61 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 20' ' ' PHE . 58.2 tttm -94.55 122.91 37.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.875 178.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -136.47 111.01 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -118.15 3.71 12.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.249 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.7 mt -71.86 137.62 47.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -79.81 59.58 3.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.87 0.843 . . . . 0.0 110.238 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -139.76 150.58 63.4 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.136 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.57 147.85 46.59 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.187 1.925 . . . . 0.0 111.898 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.11 130.87 93.19 Favored Pre-proline 0 N--CA 1.449 -0.49 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.03 176.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.468 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 41.8 Cg_endo -68.19 168.61 18.75 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.848 2.365 . . . . 0.0 112.994 -177.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 41.1 p -104.33 165.29 11.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.546 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -57.36 -43.77 83.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.291 0.567 . . . . 0.0 109.735 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.79 -47.82 73.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.97 -1.014 . . . . 0.0 110.633 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.434 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 30.4 mt-10 -58.24 -53.42 58.48 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 176.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.8 mt -52.31 -49.09 64.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.627 -177.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.72 -33.45 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.627 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 91.8 m -64.08 -45.28 89.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.554 0.216 . . . . 0.0 110.556 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.654 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.0 m0 -63.72 -42.13 97.98 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -63.1 -44.31 96.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.801 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -62.29 -46.73 87.44 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.497 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.547 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 45.5 mt-10 -64.0 -37.35 87.1 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.861 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.9 tp -65.09 -30.03 70.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.869 0.366 . . . . 0.0 110.914 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -91.39 -39.76 11.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.091 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -88.4 -15.8 34.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.162 0.506 . . . . 0.0 111.447 -173.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.547 ' HB3' ' O ' ' A' ' 52' ' ' GLU . 9.0 t30 . . . . . 0 C--N 1.315 -0.929 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.533 176.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 ttt . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.471 ' N ' HD12 ' A' ' 2' ' ' ILE . 3.9 mp -87.13 112.62 23.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.22 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.457 HD11 HD13 ' A' ' 46' ' ' LEU . 2.9 mm? -70.13 -34.36 72.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.113 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -51.17 -49.18 61.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.861 -175.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.25 -51.09 70.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.339 -177.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.72 90.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.461 -177.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 3' ' ' LEU . 77.8 mt -63.25 -47.86 90.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.249 -178.36 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.4 ttm -76.25 -16.99 59.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.969 0.414 . . . . 0.0 111.012 -174.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.438 ' CD2' ' HB3' ' A' ' 49' ' ' TRP . 92.4 t80 -69.38 -44.72 70.9 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 174.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -82.07 -37.21 26.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.092 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -124.17 97.74 39.91 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 121.069 0.462 . . . . 0.0 111.226 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -66.53 -27.81 45.93 Favored 'Trans proline' 0 CA--C 1.528 0.185 0 C-N-CA 122.857 2.371 . . . . 0.0 112.567 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -87.34 8.82 22.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.667 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.528 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -78.71 107.06 11.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.895 0.379 . . . . 0.0 110.526 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.67 105.83 15.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.406 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m -70.03 140.97 52.94 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.441 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 71.38 12.4 6.65 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.577 177.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -116.38 -76.48 0.57 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -91.5 -31.24 16.03 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.147 0.499 . . . . 0.0 110.415 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.528 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 17.2 p90 -127.62 135.67 50.58 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 170.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -130.51 139.96 50.5 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.464 0.649 . . . . 0.0 110.557 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.0 mt -93.61 146.86 23.51 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.493 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.428 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.9 mpt_? -130.92 169.8 15.31 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 176.07 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -92.3 117.86 30.32 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.441 -175.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -86.82 -26.24 24.16 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 132.18 -38.31 1.91 Allowed Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.03 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -87.44 -22.34 25.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.355 0.598 . . . . 0.0 110.427 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 171.02 -160.24 32.58 Favored Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.351 177.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 m -99.24 112.3 24.49 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -116.9 173.63 6.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.442 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.6 mt -69.96 114.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.248 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.428 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 1.6 tm-20 -121.1 -53.62 2.04 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.678 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.82 116.91 32.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -129.36 111.86 13.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -114.55 3.88 15.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.921 0.391 . . . . 0.0 110.813 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.8 mt -70.66 145.58 50.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.89 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -81.79 49.03 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.144 0.497 . . . . 0.0 110.396 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . . . -146.17 140.05 15.11 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.808 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 38' ' ' ALA . 38.6 Cg_exo -61.92 148.25 93.52 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.075 2.517 . . . . 0.0 112.59 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.08 142.95 90.82 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.296 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.19 171.72 16.27 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.387 2.058 . . . . 0.0 110.963 170.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.7 p -104.6 167.77 9.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.49 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -56.61 -47.95 78.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.136 0.493 . . . . 0.0 110.021 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.11 -48.88 73.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.172 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -57.39 -49.73 75.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.303 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.457 HD13 HD11 ' A' ' 3' ' ' LEU . 91.7 mt -55.59 -47.74 76.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.046 0.45 . . . . 0.0 111.184 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -75.9 -18.0 59.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.635 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.3 m -64.92 -50.08 67.88 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.438 ' HB3' ' CD2' ' A' ' 9' ' ' TYR . 8.1 m0 -67.26 -31.74 72.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.22 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -62.09 -44.77 95.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.927 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -60.8 -46.19 91.49 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.842 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.39 -35.8 81.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.915 0.388 . . . . 0.0 111.0 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.3 tp -65.42 -38.84 91.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.667 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.71 -25.37 41.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.127 0.489 . . . . 0.0 110.435 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.444 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 43.2 tttm -87.16 18.92 3.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.244 178.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 55' ' ' LYS . 11.5 t30 . . . . . 0 N--CA 1.467 0.386 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.408 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.4 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.421 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.4 mp -104.87 115.31 46.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.512 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.2 OUTLIER -63.44 -32.76 74.29 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.096 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.402 ' HE1' ' HB3' ' A' ' 16' ' ' SER . 22.8 t80 -52.98 -48.57 67.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.084 -176.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.6 -48.8 79.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.351 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.69 -43.78 85.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.432 178.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -67.09 -38.31 80.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.54 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.0 mmt -68.64 -22.5 64.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.481 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -79.25 -38.31 35.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.848 0.356 . . . . 0.0 110.309 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? -80.68 -50.78 9.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.96 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -118.81 85.33 27.79 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.992 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.64 -20.85 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.624 2.216 . . . . 0.0 112.879 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -90.1 -8.34 51.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.073 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.14 141.93 58.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.327 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.448 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 33.4 t -104.12 128.44 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.14 0.495 . . . . 0.0 110.738 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.402 ' HB3' ' HE1' ' A' ' 4' ' ' TYR . 3.0 p -70.67 141.81 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.321 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 43.2 mtt180 65.55 25.12 11.77 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.513 0.673 . . . . 0.0 110.705 -176.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 84.8 tttt -140.92 -60.16 0.5 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.382 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.401 ' HB3' HD21 ' A' ' 36' ' ' LEU . 33.8 m-20 -86.98 -38.36 16.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.865 176.632 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 p90 -152.26 149.37 28.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.043 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 66.7 tt0 -136.02 135.39 39.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.466 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 48.9 mt -117.24 155.19 29.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.863 0.363 . . . . 0.0 111.627 -170.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 29' ' ' SER . 5.6 mpt_? -124.22 173.73 8.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.017 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -98.43 119.55 37.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.655 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -81.1 -33.08 33.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.226 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.96 -36.25 3.51 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -170.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -95.33 9.41 39.97 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 173.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 134.27 -176.7 19.68 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.789 -178.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.454 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 11.1 m -84.67 130.57 34.69 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -120.42 171.43 8.54 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 110.606 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.512 HG13 ' HG ' ' A' ' 3' ' ' LEU . 62.7 mt -82.33 121.77 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.23 -176.457 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -108.75 -58.41 2.01 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 176.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 32.0 mmtp -99.17 131.74 44.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.516 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -133.58 111.62 10.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 175.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -114.18 1.29 14.5 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.081 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.401 HD21 ' HB3' ' A' ' 19' ' ' ASP . 76.8 mt -78.73 147.71 33.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 -177.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.7 mtp180 -87.5 36.06 0.74 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.432 177.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.23 141.1 38.81 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.006 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.79 148.73 93.05 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.826 2.35 . . . . 0.0 112.459 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.91 128.59 93.37 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.661 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.43 ' HG2' HD21 ' A' ' 46' ' ' LEU . 56.1 Cg_endo -71.23 171.67 15.57 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.546 2.164 . . . . 0.0 111.909 176.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.475 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.9 p -93.6 165.29 12.8 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.702 -177.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -59.22 -39.66 83.37 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.168 178.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.92 95.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.314 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.55 -48.48 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.879 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 42' ' ' THR . 99.7 mt -55.35 -47.2 76.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.336 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.39 -28.28 66.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.0 m -62.94 -50.76 69.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.565 0.222 . . . . 0.0 110.807 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -65.1 -38.56 91.1 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-O 120.974 0.416 . . . . 0.0 110.276 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -58.76 -49.26 78.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.714 177.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.86 -44.51 96.91 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 123.141 0.576 . . . . 0.0 111.765 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.488 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.26 -38.08 82.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.903 0.382 . . . . 0.0 110.474 177.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -69.65 -38.87 77.3 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.544 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -79.65 -13.18 59.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.898 0.38 . . . . 0.0 111.884 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 . . . . . 0 C--N 1.316 -0.862 0 CA-C-O 120.918 0.389 . . . . 0.0 111.721 -175.744 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.0 mp -104.43 111.1 32.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.929 0.395 . . . . 0.0 110.151 178.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.732 ' HG ' HG13 ' A' ' 31' ' ' ILE . 2.8 mm? -70.04 -30.59 67.91 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.4 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -50.45 -40.4 50.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.79 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.401 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 23.7 m-20 -67.56 -55.3 14.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.61 -177.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.87 86.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.57 -176.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.0 mt -64.06 -44.86 97.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.268 -177.648 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 69.9 mtp -81.88 -9.04 59.71 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.485 -176.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -77.39 -38.9 48.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.64 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 61.9 tttm -81.35 -38.19 27.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.239 177.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.53 ' HB2' ' HB2' ' A' ' 14' ' ' ALA . 85.1 m-85 -121.08 98.58 47.16 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.536 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.77 -24.49 68.64 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.609 2.206 . . . . 0.0 111.973 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -98.53 17.86 18.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.043 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.53 ' HB2' ' HB2' ' A' ' 11' ' ' TYR . . . -86.76 101.41 13.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.141 0.496 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 37.7 t -88.79 117.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.449 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 p -72.04 150.6 43.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.468 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 64.88 23.05 12.59 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -125.05 -72.06 0.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.037 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.7 t0 -109.25 4.83 23.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.786 0.803 . . . . 0.0 110.022 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.495 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 39.6 p90 -165.27 127.18 2.07 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 171.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -113.33 130.42 56.27 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.126 0.489 . . . . 0.0 111.169 -172.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.34 153.2 24.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.667 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.508 ' NH1' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -133.32 173.96 10.91 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.246 0.546 . . . . 0.0 111.208 176.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -99.52 123.62 43.96 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.204 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.434 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 7.1 t70 -98.19 -34.64 10.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.224 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.74 -29.14 5.94 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -174.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -100.36 -8.93 22.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.611 0.72 . . . . 0.0 109.588 175.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.8 177.42 30.89 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.776 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.2 m -96.13 115.48 27.5 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.434 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 53.5 p90 -106.17 171.24 7.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.806 -172.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.732 HG13 ' HG ' ' A' ' 3' ' ' LEU . 58.5 mt -87.45 118.71 33.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.977 176.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.508 ' HG2' ' NH1' ' A' ' 23' ' ' ARG . 8.9 tp10 -101.97 -56.55 2.25 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.78 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -121.29 113.09 19.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.336 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.442 ' CH2' HD12 ' A' ' 36' ' ' LEU . 58.1 t-105 -106.83 112.53 25.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.173 -174.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 6.1 m-20 -110.86 1.94 17.94 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -177.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.442 HD12 ' CH2' ' A' ' 34' ' ' TRP . 90.7 mt -69.57 141.42 53.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.32 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -82.59 41.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.489 0.661 . . . . 0.0 110.748 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.13 142.17 40.84 Favored Pre-proline 0 C--N 1.315 -0.935 0 CA-C-N 115.104 -0.953 . . . . 0.0 108.774 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.4 155.74 50.54 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.381 2.054 . . . . 0.0 111.962 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.4 mm? -65.8 120.55 69.75 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.598 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -62.69 168.83 9.47 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.918 2.412 . . . . 0.0 112.117 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.4 p -94.1 167.03 11.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.74 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -62.57 -44.19 96.93 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.898 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.79 -45.05 86.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.208 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -57.7 -54.11 50.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.818 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.451 ' HA ' ' CE3' ' A' ' 49' ' ' TRP . 93.3 mt -55.21 -46.21 75.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.826 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.77 -20.77 59.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -177.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 88.5 m -70.83 -44.35 66.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.107 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.64 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 9.5 m0 -64.31 -36.97 85.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.424 ' O ' ' HB2' ' A' ' 54' ' ' GLN . 62.0 t-105 -60.97 -42.75 98.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.312 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -70.51 -43.39 69.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.23 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -61.8 -40.78 96.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.401 ' CD2' ' HB3' ' A' ' 5' ' ' ASP . 58.5 tp -68.38 -34.35 75.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.525 176.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' A' ' 50' ' ' TRP . 0.4 OUTLIER -72.61 -25.17 61.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.063 0.458 . . . . 0.0 110.541 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 74.5 tttt -78.65 -6.76 56.55 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.506 175.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.3 t30 . . . . . 0 N--CA 1.465 0.313 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.284 -174.452 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.429 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 1.3 tmt? . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.423 HG22 ' H ' ' A' ' 4' ' ' TYR . 4.4 mp -106.28 124.52 61.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.267 -177.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.626 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 0.2 OUTLIER -65.86 -32.98 74.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.515 179.435 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.456 ' HE1' ' OG ' ' A' ' 16' ' ' SER . 81.8 t80 -52.17 -47.63 65.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.258 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.455 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 0.9 OUTLIER -60.4 -47.81 84.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.401 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.89 99.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.12 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 3' ' ' LEU . 82.1 mt -63.49 -43.25 98.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.15 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 30.6 mmt -67.71 -23.29 65.26 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.165 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -81.39 -37.7 27.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.938 0.399 . . . . 0.0 110.437 177.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -82.78 -50.81 8.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.382 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -132.33 88.02 41.13 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.467 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -68.35 -13.12 36.89 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.744 2.296 . . . . 0.0 111.3 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -75.93 -13.74 60.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.875 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.9 137.63 32.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.549 ' HB ' ' HD3' ' A' ' 18' ' ' LYS . 47.7 t -99.34 129.36 49.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.89 0.376 . . . . 0.0 110.743 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.456 ' OG ' ' HE1' ' A' ' 4' ' ' TYR . 14.9 m -62.92 134.4 56.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.253 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 70.8 3.98 4.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.533 0.733 . . . . 0.0 111.553 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.549 ' HD3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -110.96 -63.84 1.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.851 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.544 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 52.5 m-20 -90.0 -17.71 27.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.288 -177.218 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.2 p90 -153.51 130.35 10.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.517 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 33.2 tt0 -109.79 126.39 53.72 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 mt -90.77 150.85 21.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.612 0.72 . . . . 0.0 111.542 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -139.68 154.75 47.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.502 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -86.3 123.7 31.84 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.057 0.456 . . . . 0.0 110.783 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.468 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 1.7 t70 -88.86 -32.69 17.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.325 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.07 -43.61 1.52 Allowed Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -79.5 -20.03 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.451 0.644 . . . . 0.0 109.579 173.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.429 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 163.72 -172.07 39.52 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.317 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -88.19 121.66 30.84 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.626 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.3 p90 -117.94 -178.06 3.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.447 -0.205 . . . . 0.0 110.447 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.441 HD11 HD11 ' A' ' 7' ' ' ILE . 31.0 mt -91.11 121.6 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.972 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -98.65 -53.33 3.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.517 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 2.8 tppp? -94.76 104.52 16.43 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.351 178.186 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 61.5 t-105 -87.03 108.89 19.06 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 168.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -106.91 -2.97 20.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.463 0.649 . . . . 0.0 110.41 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.544 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 73.2 mt -86.95 147.62 25.68 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.873 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.2 mtp180 -92.57 36.2 1.01 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.474 ' HB1' ' HD2' ' A' ' 39' ' ' PRO . . . -111.2 161.74 23.83 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 114.41 -1.268 . . . . 0.0 109.943 -177.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' 38' ' ' ALA . 30.8 Cg_endo -64.39 150.05 88.97 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.642 2.228 . . . . 0.0 112.468 178.389 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.58 134.08 51.64 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.898 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.412 ' HB3' ' CH2' ' A' ' 49' ' ' TRP . 43.0 Cg_endo -68.97 164.37 33.98 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.487 2.125 . . . . 0.0 111.375 172.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.604 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 70.3 p -95.87 167.63 11.13 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.704 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -55.88 -46.81 78.22 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.343 0.592 . . . . 0.0 109.534 173.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.75 70.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.847 176.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.01 -46.62 87.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.415 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 42' ' ' THR . 87.4 mt -57.08 -44.52 83.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.909 0.385 . . . . 0.0 111.023 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -75.02 -24.64 58.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.056 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.8 m -73.07 -41.43 64.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.398 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.412 ' CH2' ' HB3' ' A' ' 41' ' ' PRO . 51.2 m0 -66.58 -31.98 73.03 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -64.46 -36.11 83.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.944 174.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.11 -50.25 49.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.295 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -62.22 -32.79 73.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.694 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.455 ' CD2' ' HB3' ' A' ' 5' ' ' ASP . 44.9 tp -61.11 -43.06 99.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.036 176.094 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -76.65 -31.62 57.45 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.491 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -74.01 -15.17 61.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.892 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.4 t30 . . . . . 0 C--N 1.317 -0.811 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.3 179.495 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.456 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.601 HG23 ' HB2' ' A' ' 29' ' ' SER . 4.2 mp -108.47 128.86 63.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.208 -177.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.45 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -66.12 -32.55 74.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.399 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.508 ' H ' HG22 ' A' ' 2' ' ' ILE . 84.3 t80 -52.39 -45.56 65.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.685 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.36 -49.94 75.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 0.0 111.201 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.32 -45.08 95.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.295 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.29 -47.08 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.888 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.26 -29.64 70.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.83 -177.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -68.23 -45.34 73.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.048 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 10' ' ' LYS . 21.9 tptm -81.17 -35.8 30.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.887 -178.127 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -121.72 89.03 47.51 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.554 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -66.39 -22.01 53.05 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.983 2.455 . . . . 0.0 112.336 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -102.8 23.99 11.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.235 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.53 106.28 18.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.596 HG11 ' HD2' ' A' ' 18' ' ' LYS . 19.5 t -76.47 113.59 15.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.153 0.502 . . . . 0.0 111.201 -175.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.3 p -66.81 139.01 57.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.742 -178.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 68.8 6.93 5.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.448 -0.797 . . . . 0.0 112.099 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.596 ' HD2' HG11 ' A' ' 15' ' ' VAL . 50.1 mttp -119.18 -55.49 2.15 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.842 0.353 . . . . 0.0 110.265 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.455 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 10.7 t70 -91.66 -50.32 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.95 178.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -120.27 141.08 50.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.646 176.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.647 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 80.4 tt0 -129.51 131.09 46.55 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -177.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 mt -112.53 153.54 27.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.796 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.416 ' HD3' ' HA ' ' A' ' 23' ' ' ARG . 9.7 tpp180 -123.12 157.01 33.83 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.421 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -98.97 132.09 44.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.085 0.469 . . . . 0.0 111.357 -171.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -90.97 -48.3 7.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.689 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.55 -47.37 0.93 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -173.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -92.4 6.19 47.92 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.654 0.74 . . . . 0.0 109.695 174.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.456 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 161.93 -164.92 35.59 Favored Glycine 0 N--CA 1.441 -0.977 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.674 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.601 ' HB2' HG23 ' A' ' 2' ' ' ILE . 18.4 m -130.16 136.34 49.17 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 46.4 p90 -120.6 173.1 7.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.986 -173.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.45 HG13 ' HG ' ' A' ' 3' ' ' LEU . 29.7 mt -95.78 137.25 24.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.507 -175.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -129.46 -22.96 2.98 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.831 0.348 . . . . 0.0 111.184 167.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.647 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 20.7 mmtp -117.15 135.7 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.417 177.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -154.43 111.67 3.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -110.39 -9.97 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.783 179.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.455 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 69.5 mt -56.62 133.27 53.59 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.174 0.512 . . . . 0.0 111.372 -178.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -80.84 51.44 1.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.384 -178.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.18 144.42 31.52 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.159 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.29 148.06 93.9 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.725 2.283 . . . . 0.0 112.3 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.2 mm? -65.28 133.77 95.6 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.944 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.63 169.21 21.59 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.974 2.449 . . . . 0.0 112.201 178.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.527 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 23.4 p -99.96 166.83 10.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -62.89 -39.03 93.25 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.53 91.14 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.423 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.88 -44.53 96.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.884 177.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 42' ' ' THR . 98.6 mt -59.74 -44.25 93.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.849 178.351 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 43' ' ' GLN . 53.3 mt-10 -60.94 -40.21 92.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.008 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.401 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 7.9 m -64.82 -48.12 75.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.47 -177.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -62.8 -35.03 78.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.152 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.521 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -61.5 -53.26 58.79 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.83 -43.53 90.71 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 48' ' ' THR . 42.4 mt-10 -58.77 -46.62 87.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.883 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 55.4 tp -62.27 -31.85 72.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.213 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.6 mm-40 -79.98 -39.19 30.61 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.502 -178.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -84.29 -16.91 41.37 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 C--N 1.311 -1.09 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.695 -179.036 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.484 1.264 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.4 mp -106.34 106.4 20.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.994 0.426 . . . . 0.0 110.342 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.6 mm? -70.79 -32.67 69.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.41 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -51.37 -54.21 28.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.431 -175.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.404 ' HB2' ' HZ3' ' A' ' 50' ' ' TRP . 5.7 m-20 -63.89 -47.84 79.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.49 -179.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.51 -49.53 74.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -69.11 -42.05 81.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.122 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 tpt -63.74 -35.37 80.36 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.965 0.412 . . . . 0.0 110.816 -177.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -70.82 -43.66 68.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.129 178.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.427 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 6.3 tmtm? -70.72 -47.22 60.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.741 -176.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.427 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 80.3 m-85 -120.64 92.39 47.85 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.296 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -63.87 -27.56 67.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.463 2.109 . . . . 0.0 112.396 -178.497 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -94.27 12.75 25.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.424 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.88 122.35 33.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.192 0.52 . . . . 0.0 110.156 175.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -100.27 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.148 -176.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.43 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 9.2 p -84.07 39.96 0.73 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 122.003 0.906 . . . . 0.0 111.474 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.476 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 77.2 mtt180 -95.49 -72.59 0.62 Allowed 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.315 176.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.476 ' HD2' ' HB3' ' A' ' 17' ' ' ARG . 3.3 mptp? -114.66 -37.09 4.34 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.6 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.31 -44.15 88.45 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.825 0.822 . . . . 0.0 109.957 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.43 ' O ' ' HA ' ' A' ' 16' ' ' SER . 20.4 p90 -148.92 149.04 30.54 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 168.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -136.7 133.02 35.68 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.263 0.554 . . . . 0.0 110.958 -174.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.3 mt -94.85 153.92 17.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.116 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -135.22 154.21 51.66 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -178.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -75.24 123.74 25.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.548 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 11.7 t70 -87.35 -28.35 22.27 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.715 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.15 -43.56 1.69 Allowed Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 -173.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -100.31 10.67 40.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.977 0.894 . . . . 0.0 109.099 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.14 -160.55 30.53 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.779 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.507 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 19.3 m -130.92 121.51 25.31 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.548 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -125.74 -179.17 4.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.841 0.353 . . . . 0.0 110.924 -173.548 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.3 mt -84.04 118.99 32.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.144 0.497 . . . . 0.0 111.318 -175.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -90.14 -56.22 3.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.002 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -115.84 148.4 39.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.885 -178.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -150.44 111.39 4.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.267 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -120.05 7.38 10.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.044 0.45 . . . . 0.0 110.505 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.3 147.6 51.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -86.88 51.15 2.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.619 0.723 . . . . 0.0 109.983 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.32 146.33 57.51 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.302 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.45 136.61 77.06 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.865 2.377 . . . . 0.0 112.581 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.85 116.94 24.12 Favored Pre-proline 0 C--N 1.333 -0.138 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -60.47 151.0 78.09 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.672 2.248 . . . . 0.0 112.164 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.5 p -99.34 175.43 5.87 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.416 -178.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -53.79 -52.29 60.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.174 0.511 . . . . 0.0 110.759 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.63 -48.1 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -58.92 -49.94 75.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.496 HD22 HD11 ' A' ' 3' ' ' LEU . 80.2 mt -57.87 -49.11 77.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.207 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 42.4 mt-10 -69.15 -33.53 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.833 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -62.48 -41.9 99.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.682 0.277 . . . . 0.0 110.883 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -66.83 -35.2 79.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 110.257 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.404 ' HZ3' ' HB2' ' A' ' 5' ' ' ASP . 76.9 t-105 -66.66 -40.89 88.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.964 174.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.0 mt-10 -63.21 -43.9 96.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.264 177.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 39.0 mt-10 -62.33 -40.34 96.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.443 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 tp -65.94 -40.42 91.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.053 0.454 . . . . 0.0 110.454 176.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -66.0 -32.08 73.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.376 0.608 . . . . 0.0 110.615 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 46.5 tttm -100.06 14.23 31.35 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.856 -178.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 64.0 t30 . . . . . 0 C--N 1.324 -0.523 0 O-C-N 122.145 -0.347 . . . . 0.0 111.175 -177.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.6 mp -104.79 112.59 39.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.898 0.38 . . . . 0.0 110.434 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.51 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.6 mm? -70.41 -32.56 70.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.805 -178.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.499 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . 70.0 t80 -49.89 -52.42 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.74 -173.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.546 ' HB3' HD13 ' A' ' 53' ' ' LEU . 6.2 m-20 -66.76 -49.39 66.08 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.855 -177.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.23 -44.54 75.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.824 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 3' ' ' LEU . 73.2 mt -66.95 -48.83 78.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.694 -176.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.2 mtp -74.37 -22.26 59.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.161 -174.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -71.98 -37.81 69.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.093 0.473 . . . . 0.0 110.19 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -79.21 -48.92 13.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.993 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -116.14 101.17 53.94 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.914 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.41 -14.5 28.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.771 2.314 . . . . 0.0 112.369 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -94.13 4.97 53.15 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.219 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -100.69 117.73 35.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.757 0.313 . . . . 0.0 110.441 -177.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.565 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 45.3 t -95.77 129.29 46.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.832 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -68.15 139.49 56.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.0 mtt-85 66.54 6.06 4.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.59 -177.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.565 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -109.95 -64.95 1.2 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.487 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 46.2 m-20 -93.08 -25.64 17.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.913 -176.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.505 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 44.9 p90 -147.91 131.82 17.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.427 177.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.852 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 31.2 tt0 -120.06 134.97 55.1 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.499 ' CD1' ' HB2' ' A' ' 4' ' ' TYR . 35.9 mt -95.79 153.67 17.62 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.656 -170.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.0 162.8 34.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.648 175.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 -100.16 135.4 41.65 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 120.835 0.35 . . . . 0.0 110.647 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.422 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 12.9 t70 -99.39 -42.01 7.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.289 0.566 . . . . 0.0 109.996 175.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.45 -63.22 0.16 Allowed Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 -178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -112.0 17.4 19.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.584 0.706 . . . . 0.0 110.104 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -170.52 163.87 37.09 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.873 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.436 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 16.3 m -115.92 116.17 27.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 19.8 p90 -113.55 -175.96 2.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.587 -175.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 mt -89.96 126.48 42.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.799 0.333 . . . . 0.0 111.649 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -104.9 -56.17 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 172.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.852 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 17.3 mmtm -85.91 104.27 15.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.928 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.402 ' CH2' HD12 ' A' ' 36' ' ' LEU . 28.9 t-105 -101.95 112.34 24.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 174.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.487 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 16.3 m120 -116.39 17.24 15.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.288 -175.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.402 HD12 ' CH2' ' A' ' 34' ' ' TRP . 87.9 mt -106.67 149.62 27.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.395 179.186 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -89.46 35.93 0.83 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.293 0.568 . . . . 0.0 110.064 177.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . . . -114.51 141.8 27.17 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.345 -176.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 38' ' ' ALA . 22.0 Cg_exo -64.57 141.92 75.43 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 123.109 2.539 . . . . 0.0 111.852 175.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 4.0 mm? -66.75 138.37 95.34 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.583 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 40' ' ' LEU . 6.2 Cg_exo -77.39 -174.84 2.37 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.22 2.614 . . . . 0.0 112.248 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.471 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 82.1 p -105.04 170.86 7.63 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.442 -178.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.27 -48.08 81.49 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.144 0.278 . . . . 0.0 110.922 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.47 -44.09 72.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.04 -55.17 38.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.398 177.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.5 mt -56.41 -47.14 79.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.9 -29.54 67.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.089 -176.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 87.9 m -67.24 -44.2 80.02 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.376 178.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.437 ' CZ3' HD23 ' A' ' 46' ' ' LEU . 25.3 m0 -60.82 -45.17 95.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.157 0.503 . . . . 0.0 109.88 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.4 t-105 -59.27 -47.92 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.771 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.04 -41.46 95.19 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.167 -0.469 . . . . 0.0 112.243 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -60.12 -40.87 91.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.768 0.318 . . . . 0.0 110.713 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.546 HD13 ' HB3' ' A' ' 5' ' ' ASP . 9.9 tt -64.96 -42.19 94.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.778 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -69.01 -35.89 77.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.274 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -92.18 6.56 46.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.032 -175.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 54.3 t30 . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.824 178.273 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.4 HG22 ' HB3' ' A' ' 4' ' ' TYR . 3.1 mp -113.44 116.71 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.13 -32.35 73.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.926 0.393 . . . . 0.0 110.823 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.4 ' HB3' HG22 ' A' ' 2' ' ' ILE . 87.8 t80 -52.27 -48.42 65.3 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.1 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -61.63 -51.27 69.18 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.524 -178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.92 -46.35 88.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.569 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.407 HG21 ' CZ ' ' A' ' 20' ' ' PHE . 84.4 mt -67.65 -46.26 83.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.966 -178.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.478 ' HE2' ' HA ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -66.03 -31.66 72.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.005 0.431 . . . . 0.0 110.694 -176.933 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.429 ' OH ' ' HB3' ' A' ' 52' ' ' GLU . 13.5 t80 -63.76 -51.64 63.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.112 177.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.4 tttp -81.75 -43.11 18.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.616 -174.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -123.03 94.08 47.61 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.937 0.398 . . . . 0.0 110.708 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.466 ' HA ' ' HE2' ' A' ' 8' ' ' MET . 61.2 Cg_endo -73.77 -18.11 22.34 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.675 2.25 . . . . 0.0 112.5 -177.494 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.39 1.73 43.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.295 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.445 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -87.26 143.47 27.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.1 0.476 . . . . 0.0 111.054 -179.099 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.443 HG12 ' H ' ' A' ' 17' ' ' ARG . 98.7 t -127.32 123.14 61.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.449 177.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -88.96 37.43 0.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.713 0.768 . . . . 0.0 111.475 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.443 ' H ' HG12 ' A' ' 15' ' ' VAL . 20.7 mtp180 -99.23 -55.86 2.57 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.596 170.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -105.47 -67.32 0.93 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.904 -168.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.537 ' HB3' HD21 ' A' ' 36' ' ' LEU . 3.9 m-20 -52.48 -39.69 61.48 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.54 -175.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.445 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 37.8 p90 -158.17 176.96 11.82 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.652 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 45.1 tt0 -152.47 148.8 27.84 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.931 0.396 . . . . 0.0 110.468 179.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 31' ' ' ILE . 17.2 mt -116.7 145.53 43.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.678 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.531 ' HD2' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mtt180 -141.99 148.44 38.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.256 0.551 . . . . 0.0 110.832 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -92.98 121.97 34.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.921 -175.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.75 -47.01 6.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.504 179.128 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.06 -35.25 1.86 Allowed Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -76.63 -25.56 53.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.921 0.867 . . . . 0.0 108.928 169.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 165.34 -175.09 41.19 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.251 -1.34 . . . . 0.0 111.549 -179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.5 m -108.35 108.97 20.17 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -121.66 -177.57 3.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.716 0.293 . . . . 0.0 111.315 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.427 ' HA ' HD23 ' A' ' 22' ' ' LEU . 13.2 mt -84.72 124.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.741 -175.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.531 ' HG2' ' HD2' ' A' ' 23' ' ' ARG . 0.6 OUTLIER -113.21 -18.92 11.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.849 0.357 . . . . 0.0 110.978 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.623 ' HZ2' ' HB2' ' A' ' 33' ' ' LYS . 3.8 ttmp? -126.38 140.81 52.21 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.0 t-105 -153.68 113.49 3.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.615 0.245 . . . . 0.0 110.624 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -117.79 -1.84 11.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.013 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 19' ' ' ASP . 88.0 mt -73.91 152.12 40.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.659 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.9 mtt180 -85.88 45.99 1.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.943 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.43 139.75 30.49 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.369 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.12 145.52 67.2 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.411 2.074 . . . . 0.0 111.469 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.2 mm? -65.7 127.38 93.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.782 -179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.432 ' HG2' HD21 ' A' ' 46' ' ' LEU . 30.5 Cg_endo -63.68 164.55 20.88 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.875 2.383 . . . . 0.0 112.028 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 p -97.2 172.29 7.9 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.342 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -50.43 -55.2 16.86 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.093 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.85 77.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.135 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.86 -44.8 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.449 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.432 HD21 ' HG2' ' A' ' 41' ' ' PRO . 92.6 mt -61.55 -43.72 98.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.972 0.415 . . . . 0.0 111.21 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.27 -29.02 64.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.294 -178.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.1 m -62.98 -44.59 95.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.655 177.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.7 m0 -68.17 -37.45 81.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.419 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.584 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 66.4 t-105 -60.89 -49.4 77.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.788 174.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -58.32 -41.8 85.35 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.489 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.429 ' HB3' ' OH ' ' A' ' 9' ' ' TYR . 79.7 mt-10 -62.35 -45.51 92.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.012 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.425 HD13 ' HB2' ' A' ' 9' ' ' TYR . 67.3 tp -60.14 -32.77 71.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.787 0.327 . . . . 0.0 111.052 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.4 mm-40 -81.26 -40.57 23.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.815 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -85.17 -17.88 35.84 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.341 0.591 . . . . 0.0 112.39 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 . . . . . 0 C--N 1.307 -1.262 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.826 -177.559 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ttt . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.658 0.266 . . . . 0.0 110.717 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.438 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.1 mp -95.85 106.02 17.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.707 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.4 mm? -71.42 -32.77 68.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.33 -175.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.435 ' CD1' HD11 ' A' ' 22' ' ' LEU . 87.0 t80 -51.35 -51.8 51.25 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.945 -174.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.85 -46.8 86.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.982 0.42 . . . . 0.0 111.065 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.511 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -61.76 -47.09 86.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.596 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.8 mt -65.83 -42.14 91.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.489 ' HE2' ' HA ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -63.81 -28.69 70.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.432 178.929 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -71.15 -36.62 72.12 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.963 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.627 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 85.1 tttt -86.85 -36.75 18.28 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.239 -179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -129.55 88.96 48.44 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.787 0.327 . . . . 0.0 111.054 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.489 ' HA ' ' HE2' ' A' ' 8' ' ' MET . 73.0 Cg_endo -77.24 -21.35 11.97 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.709 2.272 . . . . 0.0 113.146 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.56 5.99 45.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.428 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.22 147.1 23.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.542 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 38.9 t -95.32 128.29 46.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.019 0.438 . . . . 0.0 111.058 -176.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.6 m -61.68 138.54 58.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.812 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.532 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 0.7 OUTLIER 69.95 -3.82 1.64 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.571 0.748 . . . . 0.0 111.92 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.542 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 61.6 tttp -112.17 -61.12 1.76 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.777 0.322 . . . . 0.0 110.426 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.413 ' HB3' HD21 ' A' ' 36' ' ' LEU . 28.6 m-20 -85.91 -37.17 19.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.379 0.609 . . . . 0.0 109.974 177.313 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -134.07 114.42 13.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.947 173.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.557 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 43.7 tt0 -96.54 141.56 29.68 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.488 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.435 HD11 ' CD1' ' A' ' 4' ' ' TYR . 44.1 mt -107.59 153.3 23.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.097 0.475 . . . . 0.0 111.589 -172.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.608 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 29.7 ttt180 -132.65 122.35 24.54 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.826 174.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.434 ' HA ' ' HA ' ' A' ' 29' ' ' SER . 47.5 t30 -97.19 116.02 28.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.186 0.517 . . . . 0.0 110.675 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -95.56 -11.62 27.05 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.557 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.52 -47.26 1.07 Allowed Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 -174.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -71.49 -17.39 62.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.732 0.777 . . . . 0.0 109.794 174.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 164.95 161.75 14.56 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.999 178.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' ASN . 19.7 m -99.76 108.72 21.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.707 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 43.0 p90 -111.71 -168.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.685 0.279 . . . . 0.0 111.117 -176.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -76.54 122.99 32.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.087 0.47 . . . . 0.0 111.833 -174.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.608 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 9.2 tp10 -96.06 -61.67 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.157 172.604 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.557 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -119.98 119.04 32.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.115 -176.526 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -99.55 111.07 23.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -115.51 11.32 15.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.49 0.662 . . . . 0.0 110.1 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.413 HD21 ' HB3' ' A' ' 19' ' ' ASP . 84.2 mt -89.73 140.03 29.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -82.65 44.93 0.93 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.476 0.655 . . . . 0.0 110.351 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.05 147.3 65.29 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.417 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -55.5 145.15 70.39 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 123.016 2.477 . . . . 0.0 112.654 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.74 125.02 85.43 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.155 177.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.415 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 13.2 Cg_endo -58.58 147.35 87.28 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.912 2.408 . . . . 0.0 113.087 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.429 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.7 p -83.49 157.98 22.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.208 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -57.43 -42.85 83.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.12 0.486 . . . . 0.0 110.296 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.49 -51.85 66.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.412 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.69 -42.45 98.01 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.662 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.46 HD22 HD11 ' A' ' 3' ' ' LEU . 90.5 mt -54.26 -53.52 52.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.198 177.085 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -71.22 -18.99 62.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.627 -177.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 95.0 m -70.97 -46.69 61.9 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 174.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.627 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.7 m0 -61.5 -40.72 95.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.995 0.426 . . . . 0.0 109.876 177.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -60.11 -44.38 94.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.376 176.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -60.53 -49.48 77.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.457 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -63.68 -35.69 81.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.727 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.99 -45.7 87.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.643 175.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -69.75 -27.97 65.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.024 0.44 . . . . 0.0 111.185 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -84.4 1.28 46.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.1 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.5 t30 . . . . . 0 N--CA 1.466 0.337 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.012 -179.776 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 120.576 0.227 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 30.4 mm -88.57 107.06 17.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 110.331 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.742 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.1 mm? -70.13 -35.57 74.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.873 0.368 . . . . 0.0 110.789 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.497 ' HB2' HD13 ' A' ' 22' ' ' LEU . 71.3 t80 -52.46 -50.65 62.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.924 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.473 ' OD1' HD11 ' A' ' 53' ' ' LEU . 0.7 OUTLIER -65.83 -38.36 88.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -174.873 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.54 -44.29 78.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.018 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 3' ' ' LEU . 87.9 mt -61.65 -49.21 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.427 179.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -69.56 -22.73 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.84 -177.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -67.66 -41.98 82.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -92.01 -40.11 11.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.255 -178.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -119.26 97.05 50.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.097 -176.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -74.61 -13.66 22.3 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.555 2.17 . . . . 0.0 111.419 175.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -87.4 2.2 51.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.441 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -87.3 105.35 17.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.958 0.409 . . . . 0.0 110.815 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.1 t -81.9 117.74 28.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.774 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m -69.36 149.87 47.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.578 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 64.83 22.41 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.525 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -146.06 -72.36 0.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.084 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.554 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 4.4 m-20 -80.41 -17.42 51.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.356 0.598 . . . . 0.0 110.429 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.441 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 40.3 p90 -160.07 144.81 14.79 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.092 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -118.91 131.21 56.04 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.729 0.3 . . . . 0.0 110.196 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' A' ' 4' ' ' TYR . 29.0 mt -102.77 153.35 20.25 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.457 ' O ' ' HA ' ' A' ' 29' ' ' SER . 4.1 mtt180 -137.4 148.24 46.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.675 174.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -89.33 126.88 35.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.222 -174.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.72 -13.07 16.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.54 -33.72 6.15 Favored Glycine 0 N--CA 1.453 -0.216 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -172.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -87.93 2.45 51.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.07 0.938 . . . . 0.0 109.1 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 130.86 176.12 14.29 Favored Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.449 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.457 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 19.3 m -104.69 122.5 45.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.767 0.317 . . . . 0.0 110.269 177.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.742 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 2.9 p90 -120.61 -179.75 4.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.353 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.83 120.68 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.416 -173.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -94.09 -58.33 2.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.165 0.507 . . . . 0.0 109.707 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -115.67 145.88 42.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.973 -178.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.2 t-105 -128.02 111.93 14.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.114 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -113.7 -2.83 13.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 -179.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.554 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 34.7 mt -66.02 140.75 58.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -84.85 39.53 0.76 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.683 0.754 . . . . 0.0 110.197 178.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -123.36 154.71 65.81 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.961 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -69.48 151.41 70.69 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.082 1.855 . . . . 0.0 112.222 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.0 mm? -71.24 116.66 49.24 Favored Pre-proline 0 N--CA 1.45 -0.467 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.17 175.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.408 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 33.3 Cg_endo -65.32 159.58 46.61 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.513 2.142 . . . . 0.0 112.224 178.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.2 p -92.29 167.58 11.91 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.45 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -55.5 -45.98 77.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.154 0.502 . . . . 0.0 110.005 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.84 91.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.178 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.3 -43.68 96.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.075 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.5 mt -60.17 -46.93 88.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.181 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -68.89 -24.44 64.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.338 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.9 m -63.68 -50.8 67.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.814 0.34 . . . . 0.0 110.779 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.408 ' HH2' ' HB3' ' A' ' 41' ' ' PRO . 8.8 m0 -70.46 -32.16 69.6 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.181 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -64.93 -41.85 95.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.783 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.38 -51.08 71.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.194 175.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -63.96 -30.84 71.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.071 0.462 . . . . 0.0 111.231 -178.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.473 HD11 ' OD1' ' A' ' 5' ' ' ASP . 6.6 tt -65.93 -38.25 88.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.154 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.74 -32.58 20.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.552 -178.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.99 -15.62 58.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.379 0.609 . . . . 0.0 110.578 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.9 t30 . . . . . 0 C--N 1.315 -0.911 0 CA-C-N 115.013 -0.994 . . . . 0.0 108.854 171.337 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.554 ' H ' HD12 ' A' ' 2' ' ' ILE . 4.1 mp -74.0 106.35 3.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.489 ' HG ' HG13 ' A' ' 31' ' ' ILE . 2.5 mm? -64.49 -34.96 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.731 -173.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -51.23 -47.02 62.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.479 -175.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -68.87 -51.23 42.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.986 0.422 . . . . 0.0 110.884 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.479 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -57.1 -45.74 83.16 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.058 -178.297 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.8 mt -65.69 -41.91 91.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -177.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 61.0 mtp -72.84 -19.14 61.37 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.101 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -74.65 -33.58 62.55 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 173.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -75.97 -54.45 6.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.679 178.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -120.69 91.95 47.58 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -63.43 -24.37 71.0 Favored 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.733 2.289 . . . . 0.0 112.817 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -93.76 10.67 32.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.809 0.338 . . . . 0.0 111.634 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -92.43 127.75 38.04 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.1 t -96.7 117.58 41.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-O 121.019 0.438 . . . . 0.0 111.192 -176.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -67.19 142.44 56.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 67.23 22.6 9.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.651 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -140.68 -69.41 0.39 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.065 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -93.35 -34.96 13.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.363 0.601 . . . . 0.0 109.609 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -130.47 132.27 45.58 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 170.013 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.614 ' HB2' ' HB3' ' A' ' 33' ' ' LYS . 49.0 mt-10 -114.19 127.8 56.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 121.265 0.555 . . . . 0.0 111.013 -175.036 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.466 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 25.5 mt -109.43 149.71 29.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.432 178.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.533 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mpt_? -130.7 164.66 24.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.903 0.382 . . . . 0.0 110.756 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -82.7 125.0 30.74 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.938 -174.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.428 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 15.8 t70 -91.1 -52.3 4.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.423 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 154.09 -35.32 0.72 Allowed Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.206 -176.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -121.4 34.45 5.19 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.83 179.78 17.11 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.788 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.8 m -113.21 137.53 51.33 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.428 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 21.7 p90 -121.6 175.57 6.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.727 0.299 . . . . 0.0 111.029 -176.135 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.489 HG13 ' HG ' ' A' ' 3' ' ' LEU . 39.9 mt -81.74 122.46 36.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.91 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.533 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -116.84 -33.05 4.91 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.569 175.324 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.614 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -124.18 133.08 53.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.55 0.214 . . . . 0.0 110.428 -179.019 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -134.34 109.49 8.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -108.25 -1.56 20.05 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.913 0.387 . . . . 0.0 110.711 -176.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.19 143.87 56.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.672 175.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -90.25 34.34 0.87 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.475 0.655 . . . . 0.0 109.949 -179.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -125.02 144.65 47.78 Favored Pre-proline 0 C--N 1.316 -0.888 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.739 -178.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -61.0 150.88 81.97 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.688 2.259 . . . . 0.0 112.287 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -66.41 139.76 96.35 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.656 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.97 166.12 19.45 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.846 2.364 . . . . 0.0 112.608 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.48 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 77.8 p -89.02 158.0 18.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.203 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -57.29 -43.58 83.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.281 0.562 . . . . 0.0 109.749 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.38 76.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.742 -1.117 . . . . 0.0 111.584 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.39 -41.35 96.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.745 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 42' ' ' THR . 95.8 mt -51.39 -50.0 60.45 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 111.132 176.699 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -62.23 -41.83 98.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.735 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.8 m -65.31 -34.69 78.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.378 -177.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.479 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 52.5 m0 -59.97 -45.86 91.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.022 0.439 . . . . 0.0 109.843 175.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 -62.45 -40.57 97.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.265 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.49 -50.29 73.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.069 177.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.06 -43.43 98.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.214 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.97 -36.0 82.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.508 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -34.35 33.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.243 -178.334 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -86.94 -11.05 51.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 . . . . . 0 C--N 1.315 -0.909 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.326 178.692 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.469 HG22 ' H ' ' A' ' 4' ' ' TYR . 3.8 mp -117.72 132.4 67.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.809 -179.156 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.402 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.9 mm? -59.66 -34.47 72.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.919 0.39 . . . . 0.0 111.579 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.469 ' H ' HG22 ' A' ' 2' ' ' ILE . 62.0 t80 -52.95 -53.24 52.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -60.86 -48.16 83.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.264 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.421 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -58.34 -51.0 71.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.614 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 3' ' ' LEU . 75.8 mt -62.39 -42.74 96.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.763 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -24.96 65.51 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.882 -176.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -72.21 -45.22 61.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.878 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.717 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 46.1 tttp -72.94 -49.86 26.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.66 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -115.62 94.8 41.56 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.888 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -67.54 -17.57 48.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.832 2.354 . . . . 0.0 111.814 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -95.85 9.51 40.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.909 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.868 ' HB1' ' HZ ' ' A' ' 20' ' ' PHE . . . -82.01 140.72 33.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.125 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.465 ' C ' ' H ' ' A' ' 17' ' ' ARG . 43.4 t -107.45 87.15 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.167 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 m -83.48 37.81 0.59 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 122.324 1.059 . . . . 0.0 109.581 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 15' ' ' VAL . 51.9 mtt180 -96.07 -53.96 3.47 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 113.517 -1.674 . . . . 0.0 111.137 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -145.05 -45.78 0.23 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.152 -163.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -61.94 -27.7 69.01 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.723 0.773 . . . . 0.0 109.514 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.868 ' HZ ' ' HB1' ' A' ' 14' ' ' ALA . 35.4 p90 -155.89 149.04 24.48 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.374 167.062 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 31.8 tt0 -145.04 146.11 31.74 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.301 -170.392 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 39.0 mt -97.34 151.93 19.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.3 mpt_? -136.75 168.4 19.6 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.227 175.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -87.58 126.01 34.69 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.47 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 19.9 t70 -102.22 -15.53 16.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.299 0.571 . . . . 0.0 109.99 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.43 -53.34 0.8 Allowed Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.64 10.25 21.26 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.302 0.572 . . . . 0.0 109.924 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 144.18 -170.76 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.234 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 40.2 m -102.1 123.84 46.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.829 0.347 . . . . 0.0 110.607 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.47 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.2 p90 -122.7 177.81 5.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.355 -176.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.4 mt -75.38 121.05 26.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.226 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.51 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 26.3 tt0 -122.21 -46.08 2.2 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.987 177.369 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 32.5 mtmt -89.82 131.55 35.71 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -151.2 110.72 3.99 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -175.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -107.11 1.86 24.49 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.525 -175.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.7 mt -91.65 145.93 24.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.453 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 37' ' ' ARG . 58.5 mtt180 -83.22 48.02 1.33 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.757 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.97 145.86 55.48 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.49 -178.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.93 145.16 61.04 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.344 2.03 . . . . 0.0 111.305 174.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.89 134.02 95.93 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.596 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.79 158.95 22.45 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.487 2.791 . . . . 0.0 112.924 -178.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 59.9 p -88.64 158.68 18.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.078 -175.127 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -53.64 -44.77 69.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.242 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.11 -51.89 67.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.59 -43.43 96.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.484 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.2 mt -53.93 -47.41 71.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.896 0.379 . . . . 0.0 111.231 178.586 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -72.53 -29.25 63.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.483 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.9 m -69.33 -41.22 76.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.871 176.338 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.717 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 37.9 m0 -60.08 -46.09 90.73 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 174.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -57.82 -48.74 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.593 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -56.84 -53.27 59.78 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.563 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -65.72 -30.36 71.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.442 -177.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.0 -38.79 89.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.909 0.385 . . . . 0.0 110.294 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.3 -30.9 38.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.161 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 45.4 tttt -79.46 -15.5 57.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.682 -178.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.0 t30 . . . . . 0 C--N 1.315 -0.933 0 N-CA-C 108.525 -0.916 . . . . 0.0 108.525 173.098 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.3 mp -97.51 112.7 30.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.206 0.527 . . . . 0.0 110.446 -178.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.5 HD11 HD13 ' A' ' 46' ' ' LEU . 2.4 mm? -65.71 -33.35 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.035 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -52.37 -54.18 35.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.907 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.91 -44.67 96.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.337 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.68 -51.41 69.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.421 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.56 -41.62 92.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.607 0.241 . . . . 0.0 110.745 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.59 -13.95 62.59 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.584 -179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -82.19 -40.24 22.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -76.99 -51.75 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.741 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -118.14 98.17 51.26 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.137 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.15 -31.33 54.54 Favored 'Trans proline' 0 CA--C 1.528 0.211 0 C-N-CA 123.032 2.488 . . . . 0.0 113.123 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -102.61 19.49 18.97 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -176.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.88 119.53 24.52 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.52 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.423 ' C ' ' H ' ' A' ' 17' ' ' ARG . 47.5 t -84.7 88.55 2.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.548 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.486 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 9.9 p -85.89 36.73 0.68 Allowed 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.459 1.123 . . . . 0.0 110.24 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 15' ' ' VAL . 93.8 mtt180 -97.29 -60.34 1.6 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 113.629 -1.623 . . . . 0.0 110.988 175.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.5 tttp -128.89 -43.09 1.37 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 111.655 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.611 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 5.6 t70 -65.26 -34.74 79.07 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.486 ' CE2' ' HB3' ' A' ' 16' ' ' SER . 14.1 p90 -143.44 132.08 22.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 164.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -105.13 141.72 36.18 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.744 -169.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.5 mt -113.49 152.71 29.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.687 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -144.91 174.57 10.9 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.126 0.488 . . . . 0.0 109.828 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -129.99 117.53 20.21 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.763 -176.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.92 -27.18 57.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.297 0.57 . . . . 0.0 109.703 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.54 -42.37 1.17 Allowed Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.637 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -99.47 -0.07 41.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.443 0.639 . . . . 0.0 110.644 -176.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 177.22 155.99 14.97 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.226 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.8 m -105.05 122.16 45.29 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -130.84 -179.3 5.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.983 -173.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.3 mt -87.36 132.81 31.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.585 ' HG3' ' HD2' ' A' ' 33' ' ' LYS . 13.1 pt-20 -111.63 -34.01 6.19 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.24 176.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HD2' ' HG3' ' A' ' 32' ' ' GLU . 10.1 mptt -126.02 148.71 49.23 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 175.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -144.04 111.61 6.03 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 90.1 m-20 -123.06 13.66 9.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.704 0.288 . . . . 0.0 110.643 -178.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.416 HD23 ' OD2' ' A' ' 19' ' ' ASP . 48.0 mt -66.22 153.45 42.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.183 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 37' ' ' ARG . 62.2 mtt180 -82.13 42.35 0.73 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.127 178.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -152.4 154.58 32.16 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.484 -177.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.94 171.1 17.31 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.327 2.018 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -79.51 135.63 56.7 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.794 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.63 173.51 12.45 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.724 2.282 . . . . 0.0 111.819 176.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.617 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 34.2 p -99.11 161.4 13.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.073 -177.306 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.66 -44.76 85.93 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.07 -45.86 89.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.363 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.51 -45.01 95.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.656 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.6 mt -50.89 -50.47 57.13 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.494 0.496 . . . . 0.0 111.476 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -71.28 -28.62 64.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -178.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.9 m -66.03 -38.9 89.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.88 0.371 . . . . 0.0 110.31 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -63.17 -42.98 99.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -61.89 -44.73 96.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.373 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -61.09 -46.98 88.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.427 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -66.98 -28.7 68.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.281 . . . . 0.0 111.372 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.86 -54.8 21.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.842 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.99 -32.41 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.555 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -95.85 27.61 3.46 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 32.4 p30 . . . . . 0 N--CA 1.469 0.525 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.425 -177.812 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.5 mmm . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.649 0.261 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.7 mm -87.53 110.76 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 2.3 mm? -69.22 -38.06 78.35 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.488 -175.653 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.407 ' CD1' HD11 ' A' ' 22' ' ' LEU . 27.7 t80 -54.73 -48.69 72.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.525 -176.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.4 -49.88 76.12 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.213 0.321 . . . . 0.0 111.016 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.407 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -59.88 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.587 -178.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.45 -43.55 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -23.13 66.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.855 -177.13 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -77.09 -48.61 17.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.194 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.93 -27.72 23.18 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.73 0.3 . . . . 0.0 110.649 -177.118 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -116.16 83.62 12.83 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -67.15 -28.46 40.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.904 2.403 . . . . 0.0 113.211 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -111.26 27.14 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.659 -174.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.65 141.91 34.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.64 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.522 ' HB ' ' HB2' ' A' ' 19' ' ' ASP . 41.6 t -81.02 103.72 8.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.063 0.458 . . . . 0.0 111.144 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.0 m -69.82 140.29 53.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.234 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.1 mtt-85 71.12 11.96 6.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.556 173.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -140.4 -59.66 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.796 0.331 . . . . 0.0 110.452 173.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.522 ' HB2' ' HB ' ' A' ' 15' ' ' VAL . 0.5 OUTLIER -76.39 -26.31 55.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.265 0.555 . . . . 0.0 110.024 176.955 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -142.25 114.4 8.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 166.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -94.14 136.12 34.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.582 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.407 HD11 ' CD1' ' A' ' 4' ' ' TYR . 23.3 mt -105.86 152.79 22.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.626 -175.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.848 HH11 ' HG2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -139.74 155.51 47.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.366 174.236 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -88.35 109.6 20.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.882 -178.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.543 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 28.1 t70 -84.82 -42.84 14.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.08 0.467 . . . . 0.0 111.205 -178.105 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.37 -39.09 0.93 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.675 -177.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -107.19 27.84 8.65 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.62 179.52 15.81 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.124 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 4.0 m -90.99 131.31 36.67 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.57 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 1.7 p90 -125.94 -177.95 4.12 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.0 mt -74.67 121.54 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.091 0.472 . . . . 0.0 111.449 -175.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.848 ' HG2' HH11 ' A' ' 23' ' ' ARG . 3.7 tp10 -100.22 -52.66 3.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 176.112 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -129.56 111.36 12.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.557 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -100.89 112.41 24.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 -177.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.466 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 80.6 m-20 -114.63 -6.12 12.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.621 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.462 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 36.5 mt -65.54 137.73 57.59 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.482 0.658 . . . . 0.0 111.278 -178.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -83.27 36.18 0.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.926 0.87 . . . . 0.0 109.901 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.409 ' H ' ' C ' ' A' ' 36' ' ' LEU . . . -125.08 147.48 57.15 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.458 -1.247 . . . . 0.0 109.751 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.08 144.61 94.6 Favored 'Trans proline' 0 C--O 1.238 0.525 0 C-N-CA 123.023 2.482 . . . . 0.0 113.011 178.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.403 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 4.3 mm? -66.31 126.86 92.79 Favored Pre-proline 0 N--CA 1.45 -0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.33 176.416 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.411 ' HB3' ' CH2' ' A' ' 49' ' ' TRP . 12.3 Cg_endo -57.69 150.83 59.29 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.019 2.479 . . . . 0.0 112.564 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 p -102.72 168.6 9.14 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.896 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -56.59 -54.57 44.48 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.938 -178.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.98 85.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.027 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.579 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 34.0 mt-10 -57.44 -54.34 47.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.982 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.5 mt -51.68 -49.39 62.48 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.585 -178.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.19 -31.86 68.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.649 -177.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.2 m -67.36 -44.33 79.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.901 178.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.579 ' CZ2' ' HB3' ' A' ' 45' ' ' GLU . 15.5 m0 -64.18 -39.49 94.12 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.585 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -60.31 -49.14 78.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.173 176.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -62.36 -43.89 97.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.717 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.98 -36.55 83.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.239 -0.184 . . . . 0.0 110.742 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -64.18 -39.91 94.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.806 0.336 . . . . 0.0 110.504 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.585 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 26.9 mm-40 -66.9 -37.18 83.89 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.424 0.631 . . . . 0.0 109.963 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -86.97 5.63 36.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.043 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.7 t30 . . . . . 0 C--N 1.323 -0.547 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.19 -176.048 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.6 0.238 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 59.2 mt -119.39 128.76 75.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.482 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.8 mm? -67.19 -37.58 83.92 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.248 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -52.44 -46.61 66.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.471 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.65 -47.31 85.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.828 0.347 . . . . 0.0 111.12 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.4 95.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.397 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.7 mt -63.37 -40.74 90.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.63 179.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.9 mmt -68.46 -21.93 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.74 0.305 . . . . 0.0 111.313 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -74.67 -43.44 55.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 0.0 110.541 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -90.81 -35.33 14.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.687 -175.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -121.6 84.55 42.81 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.542 0.21 . . . . 0.0 111.253 -176.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -70.9 -22.9 26.25 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.895 2.397 . . . . 0.0 112.782 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -95.94 8.36 43.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.452 -176.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.99 139.89 31.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.2 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 t -106.16 127.6 61.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 CA-C-O 121.118 0.485 . . . . 0.0 111.108 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.7 p -73.09 152.67 41.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.034 176.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.1 mtm180 65.25 17.04 10.86 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.208 0.527 . . . . 0.0 109.96 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -141.58 -73.73 0.32 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.468 -174.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.406 ' HB3' HD21 ' A' ' 36' ' ' LEU . 53.9 m-20 -80.34 -29.71 38.0 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.453 0.644 . . . . 0.0 109.857 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -139.93 136.18 33.58 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.918 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.712 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 5.8 tp10 -96.61 127.24 42.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.273 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.7 mt -100.69 153.46 19.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.977 0.417 . . . . 0.0 110.126 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -129.71 142.2 50.75 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -94.73 109.99 21.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.114 0.483 . . . . 0.0 110.878 -176.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -79.02 -39.2 34.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.399 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.19 -42.22 1.64 Allowed Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -173.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -89.13 -5.89 57.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.856 0.836 . . . . 0.0 109.024 173.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 167.93 -177.89 41.98 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.44 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 21.3 m -120.34 130.59 54.49 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.4 p90 -124.4 -179.77 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.248 0.343 . . . . 0.0 111.231 -176.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.7 mt -84.85 121.41 36.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.365 0.602 . . . . 0.0 111.466 -173.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -96.9 -58.29 2.07 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.296 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.712 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 9.7 ttmm -113.58 138.67 49.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.206 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -125.83 112.16 15.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -116.31 11.03 14.93 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.901 0.381 . . . . 0.0 111.41 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 19' ' ' ASP . 66.6 mt -87.69 144.29 26.73 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.901 0.382 . . . . 0.0 111.124 -178.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -81.5 62.88 5.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.43 0.633 . . . . 0.0 109.811 174.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.22 143.65 19.69 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.577 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.31 146.89 93.34 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.578 2.185 . . . . 0.0 111.817 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.82 118.91 62.46 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.342 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.18 146.02 97.22 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.692 2.262 . . . . 0.0 112.548 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 9.2 p -93.82 171.75 8.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.738 -177.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -53.78 -51.69 62.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.694 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.08 -42.56 76.89 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.276 178.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -50.02 72.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.957 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.9 mt -58.05 -44.48 87.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.682 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 42.6 mt-10 -65.13 -44.06 89.88 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.103 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -59.06 -43.67 91.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -61.28 -40.74 95.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.355 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.0 t-105 -66.29 -44.08 84.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.123 177.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 64.5 mt-10 -61.28 -42.4 98.59 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.887 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.34 -30.81 62.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.767 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.4 tp -77.57 -40.01 43.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.01 0.433 . . . . 0.0 111.025 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -83.47 -23.22 32.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -86.99 -16.02 36.98 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.361 0.6 . . . . 0.0 110.385 176.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -133.27 99.43 14.68 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.309 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.05 126.93 19.01 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.275 1.984 . . . . 0.0 111.306 178.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -57.87 149.54 68.99 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.614 2.209 . . . . 0.0 111.572 178.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -81.31 87.58 6.13 Favored 'General case' 0 C--N 1.321 -0.63 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 . . . . . 0 C--N 1.316 -0.864 0 CA-C-N 114.432 -1.258 . . . . 0.0 110.495 -179.244 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.436 ' SD ' ' HG2' ' A' ' 47' ' ' GLU . 18.0 ptt? . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.054 0.454 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.67 125.76 73.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.549 HD11 HD13 ' A' ' 46' ' ' LEU . 4.0 mm? -61.04 -40.29 93.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.7 -176.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.574 ' HB2' HD11 ' A' ' 22' ' ' LEU . 15.1 t80 -55.2 -51.68 65.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.222 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -60.76 -46.86 88.83 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.369 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.85 84.15 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.337 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.5 HD11 HD11 ' A' ' 31' ' ' ILE . 70.3 mt -67.27 -45.55 85.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 -179.471 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.2 mmt -65.96 -27.83 68.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.618 -176.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -75.95 -42.21 49.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.028 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.56 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 9.4 tmtt? -84.49 -36.57 22.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.827 -176.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.56 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 92.4 m-85 -127.62 88.23 54.08 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.008 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.84 -20.53 17.16 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.684 2.256 . . . . 0.0 112.266 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -86.24 5.59 33.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.892 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.65 129.67 37.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.2 t -90.37 110.28 21.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.35 0.595 . . . . 0.0 111.405 -175.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 20' ' ' PHE . 22.1 p -79.85 162.06 25.26 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 63.57 23.04 13.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.595 0.712 . . . . 0.0 110.116 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -145.89 -68.21 0.28 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.788 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.586 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 27.2 m-20 -88.93 -52.78 4.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.392 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.662 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 41.3 p90 -117.62 130.2 56.23 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.315 0.578 . . . . 0.0 111.411 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.767 ' HB2' ' HB2' ' A' ' 33' ' ' LYS . 2.0 mp0 -129.6 161.69 29.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.228 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 4' ' ' TYR . 46.5 mt -96.57 154.38 17.31 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.621 0.724 . . . . 0.0 111.971 -173.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.613 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 1.8 tpt180 -134.24 156.37 48.52 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -89.89 120.68 31.32 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.515 -0.474 . . . . 0.0 111.115 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.611 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 23.3 t70 -92.27 -23.93 19.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.923 177.097 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.8 -47.97 0.99 Allowed Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.201 -175.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.585 0.707 . . . . 0.0 109.869 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 169.43 -179.87 41.71 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.596 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 m -98.29 119.27 36.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.611 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 24.6 p90 -110.04 -179.44 3.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.842 0.353 . . . . 0.0 111.034 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.5 HD11 HD11 ' A' ' 7' ' ' ILE . 35.3 mt -91.03 123.01 43.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.797 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.613 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 2.1 tm-20 -119.93 -52.99 2.19 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.767 ' HB2' ' HB2' ' A' ' 21' ' ' GLU . 2.7 mmmp? -78.6 113.67 16.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.634 173.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -134.76 110.34 9.15 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.586 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 2.1 m-20 -118.91 4.17 11.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.196 -178.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.3 mt -73.78 141.23 46.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.072 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -79.96 46.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.341 0.591 . . . . 0.0 110.803 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.48 145.82 30.28 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.881 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.24 155.21 51.72 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.653 2.235 . . . . 0.0 112.441 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.0 mm? -71.66 137.08 83.02 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.161 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.529 ' HG2' HD21 ' A' ' 46' ' ' LEU . 74.4 Cg_endo -76.25 -177.91 4.03 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.078 2.518 . . . . 0.0 112.098 175.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.457 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 40.5 p -98.64 164.82 12.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.935 -177.041 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.423 ' HA ' HD12 ' A' ' 46' ' ' LEU . 5.8 tt0 -60.44 -46.03 91.51 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 110.038 -178.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.43 -48.09 74.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -56.95 -51.22 70.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.257 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.549 HD13 HD11 ' A' ' 3' ' ' LEU . 68.2 mt -54.88 -50.82 67.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.438 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 48.2 mt-10 -66.75 -33.35 75.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.509 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.9 m -65.87 -37.9 87.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.539 0.209 . . . . 0.0 110.705 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.472 ' CE2' ' HG3' ' A' ' 10' ' ' LYS . 22.1 m0 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.715 0.293 . . . . 0.0 110.244 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -60.92 -44.55 97.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.205 0.526 . . . . 0.0 110.03 173.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.9 mt-10 -61.38 -46.66 89.28 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.14 177.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 51.7 mt-10 -63.33 -42.28 98.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.855 178.076 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.1 tp -57.87 -43.94 86.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.916 0.389 . . . . 0.0 111.191 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -75.56 -33.12 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.908 -174.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 48.0 tttm -84.59 -7.48 59.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.04 0.448 . . . . 0.0 111.577 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 5.0 t30 -96.14 142.82 25.1 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.768 -174.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -59.66 165.37 9.87 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.137 2.558 . . . . 0.0 111.994 172.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -68.88 174.21 9.06 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.621 2.214 . . . . 0.0 112.162 178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -71.03 102.74 2.51 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.921 -175.771 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.483 1.218 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.439 ' H ' HD12 ' A' ' 2' ' ' ILE . 4.3 mp -78.87 104.42 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.484 0.659 . . . . 0.0 110.434 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -71.12 -31.92 68.36 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.265 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -51.04 -53.89 29.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.378 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.417 ' HB3' HD21 ' A' ' 53' ' ' LEU . 1.8 m-20 -64.52 -42.4 95.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.472 -178.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB1' ' HB3' ' A' ' 49' ' ' TRP . . . -59.87 -44.22 94.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.724 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 3' ' ' LEU . 83.5 mt -61.84 -42.17 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.579 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.4 mmt -66.34 -22.88 66.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.957 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -71.93 -45.99 59.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -87.75 -42.45 12.6 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.282 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -117.84 86.96 25.93 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 116.66 -0.245 . . . . 0.0 110.788 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.64 -26.84 22.99 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.742 2.295 . . . . 0.0 112.825 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -91.33 12.13 21.44 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.83 132.71 40.81 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 176.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.0 t -101.56 127.15 55.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.9 m -67.22 141.85 57.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.044 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ttm-85 61.79 22.77 13.26 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.917 0.887 . . . . 0.0 111.225 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -135.0 -62.21 0.73 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.264 172.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.461 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 47.0 m-20 -89.93 -27.68 19.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.051 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -152.06 144.36 24.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.807 177.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 39.8 tt0 -126.6 136.17 52.19 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 mt -89.83 154.08 20.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.939 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 32' ' ' GLU . 9.3 tpp180 -136.45 153.35 51.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.582 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -87.07 112.39 21.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.895 0.378 . . . . 0.0 110.354 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.538 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 19.4 t70 -82.51 -21.07 35.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.488 0.661 . . . . 0.0 110.262 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.12 -41.06 2.34 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -170.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -78.59 -6.46 55.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.062 -0.569 . . . . 0.0 110.444 173.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 143.07 -171.79 24.82 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.132 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.549 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.0 m -95.73 111.25 23.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.538 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -123.9 -176.39 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.905 -177.068 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.8 mt -81.12 131.56 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.863 0.363 . . . . 0.0 111.158 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 23' ' ' ARG . 12.8 tt0 -125.63 -58.95 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.572 173.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 7.5 tmtm? -87.65 125.97 34.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.389 -175.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -134.9 115.74 13.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.653 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -112.59 1.2 15.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.747 -176.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.461 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 77.7 mt -90.77 154.75 19.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -175.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -85.94 43.21 1.03 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -119.84 143.07 34.34 Favored Pre-proline 0 C--N 1.315 -0.897 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.226 -175.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.48 142.49 72.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.485 2.123 . . . . 0.0 112.283 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -76.35 125.31 87.81 Favored Pre-proline 0 N--CA 1.447 -0.609 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.532 ' HG3' ' CH2' ' A' ' 49' ' ' TRP . 33.9 Cg_endo -63.92 158.56 46.59 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 123.143 2.562 . . . . 0.0 112.386 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.432 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 60.5 p -81.62 169.73 16.69 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.454 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -60.34 -43.77 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.65 71.48 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -61.38 -45.25 95.16 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.768 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.493 HD22 HD11 ' A' ' 3' ' ' LEU . 88.1 mt -52.79 -48.8 66.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.594 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.21 -30.36 68.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.776 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.4 m -66.54 -38.14 86.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.417 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.532 ' CH2' ' HG3' ' A' ' 41' ' ' PRO . 46.4 m0 -56.42 -51.39 68.57 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.059 0.457 . . . . 0.0 109.855 175.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -59.21 -46.63 87.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.609 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.02 -46.45 90.7 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.673 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.34 -39.22 93.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.914 0.388 . . . . 0.0 110.815 178.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 5' ' ' ASP . 52.0 tp -64.79 -44.09 91.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.16 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -73.94 -32.8 63.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.0 -177.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.6 tttm -90.29 -3.37 57.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.729 0.3 . . . . 0.0 111.787 -173.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -114.48 148.79 41.02 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.817 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.499 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 18.7 Cg_endo -61.18 132.82 43.41 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.891 2.394 . . . . 0.0 112.634 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 38.1 Cg_exo -61.12 153.04 67.43 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 123.372 2.715 . . . . 0.0 112.76 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -66.07 126.6 29.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.364 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 . . . . . 0 C--O 1.235 0.318 0 O-C-N 123.631 0.582 . . . . 0.0 111.391 -177.327 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.855 0.359 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.65 120.39 64.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.56 -0.534 . . . . 0.0 109.56 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.531 HD11 HD22 ' A' ' 46' ' ' LEU . 2.4 mm? -70.38 -34.02 72.09 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.1 -47.43 65.26 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.416 0.447 . . . . 0.0 110.925 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.415 ' HB2' ' HZ3' ' A' ' 50' ' ' TRP . 4.5 m-20 -67.81 -48.06 67.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.155 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.15 78.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.737 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 84.2 mt -62.38 -45.53 98.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.73 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.1 ttm -73.98 -24.41 59.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.294 -175.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -65.45 -43.0 91.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 174.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -79.38 -44.3 21.77 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.571 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -122.6 92.85 48.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.354 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.18 -24.24 38.44 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.905 2.404 . . . . 0.0 112.637 -177.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -94.27 10.1 35.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.603 0.716 . . . . 0.0 110.359 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.431 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -80.51 95.36 6.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.455 174.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.2 t -77.92 110.31 13.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.48 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 18.3 m -64.99 153.55 40.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.988 176.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 17' ' ' ARG . 58.8 mtt180 75.33 -33.9 0.24 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.558 0.743 . . . . 0.0 111.004 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 16' ' ' SER . 42.4 tptt -80.02 -59.99 2.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.133 0.492 . . . . 0.0 110.255 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.603 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 11.7 t70 -100.25 -48.03 4.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.205 -176.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.431 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 29.8 p90 -131.08 143.83 50.97 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.198 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.433 ' H ' ' HB3' ' A' ' 33' ' ' LYS . 45.5 tt0 -129.86 132.99 46.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.44 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 36.2 mt -99.91 154.23 18.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.082 0.468 . . . . 0.0 111.38 -173.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.483 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -124.16 162.68 23.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.455 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -101.82 106.73 17.75 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.34 -40.95 22.77 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.3 -173.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.4 -58.6 0.16 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.539 -0.838 . . . . 0.0 112.417 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -94.2 -5.99 45.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.88 0.371 . . . . 0.0 111.225 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 176.53 179.56 47.02 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.048 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 10.4 p -105.7 132.45 51.82 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.452 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 52.6 p90 -146.13 -173.59 4.21 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.905 0.384 . . . . 0.0 111.458 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.44 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 23.6 mt -62.15 127.48 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.411 -170.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.483 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 10.2 tp10 -118.66 -58.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 172.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.26 126.95 43.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.12 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -139.7 111.58 7.39 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.95 -11.21 15.37 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.57 -0.452 . . . . 0.0 112.15 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.603 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 60.0 mt -55.3 133.36 49.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.149 0.5 . . . . 0.0 110.896 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 37' ' ' ARG . 54.9 mtt180 -80.12 61.05 3.84 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.532 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.38 141.4 16.32 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.497 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.01 137.16 75.73 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 123.068 2.512 . . . . 0.0 112.204 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.436 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 4.4 mm? -57.74 122.58 57.74 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.231 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 40' ' ' LEU . 18.5 Cg_endo -60.13 158.77 28.78 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.995 2.463 . . . . 0.0 112.234 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.587 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 27.5 p -99.81 162.69 12.84 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -51.79 -49.53 62.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.567 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.43 -46.82 83.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.028 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.97 -44.6 94.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.255 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 42' ' ' THR . 82.7 mt -58.47 -46.16 87.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.476 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.81 -34.85 76.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.755 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.415 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 58.8 m -62.57 -42.93 99.85 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.852 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.401 ' CH2' ' HB3' ' A' ' 41' ' ' PRO . 41.0 m0 -65.8 -37.11 85.38 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.952 0.406 . . . . 0.0 110.323 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.415 ' HZ3' ' HB2' ' A' ' 5' ' ' ASP . 68.6 t-105 -62.65 -45.51 92.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.005 174.042 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.54 -36.84 85.0 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.691 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 48' ' ' THR . 43.3 mt-10 -59.6 -46.53 88.69 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.126 174.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.13 -47.3 85.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.949 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -64.82 -28.31 69.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.227 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -95.56 2.51 54.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.99 0.424 . . . . 0.0 110.798 -178.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.465 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 43.1 t-20 -90.25 125.69 59.29 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.465 ' HD2' ' HA ' ' A' ' 56' ' ' ASN . 6.5 Cg_endo -49.39 145.91 15.04 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.425 2.75 . . . . 0.0 112.792 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -47.77 140.84 17.02 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.708 2.939 . . . . 0.0 113.161 -177.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -77.46 116.84 18.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.649 -176.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.8 177.789 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.863 0.363 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.69 HG23 ' HB2' ' A' ' 29' ' ' SER . 2.9 mp -90.86 122.79 42.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.014 0.435 . . . . 0.0 110.253 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.438 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.2 mm? -61.83 -30.87 71.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.129 -176.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -51.23 -45.73 62.03 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.173 -177.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -63.45 -49.58 73.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.987 0.423 . . . . 0.0 111.191 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.405 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -59.98 -46.25 90.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.515 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -63.34 -41.77 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.15 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.436 ' HA ' ' CE ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -64.37 -29.0 70.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.944 -178.207 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -76.02 -38.17 57.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.804 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.476 ' HD3' ' CE2' ' A' ' 49' ' ' TRP . 42.8 tptt -76.17 -45.46 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.81 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -126.47 83.94 63.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.218 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.58 -21.39 46.02 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.735 2.29 . . . . 0.0 112.091 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.14 4.72 47.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.638 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -98.9 138.24 36.3 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -96.83 121.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-O 120.981 0.42 . . . . 0.0 111.018 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 138.62 58.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.689 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 69.0 13.73 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.615 0.572 . . . . 0.0 111.316 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HG3' ' OD1' ' A' ' 19' ' ' ASP . 24.2 tptp -116.26 -72.82 0.67 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.405 177.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.495 ' OD1' ' HG3' ' A' ' 18' ' ' LYS . 3.0 m-20 -101.77 -1.05 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.301 0.572 . . . . 0.0 110.924 -179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -148.2 124.03 10.59 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 169.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.896 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 34.2 tt0 -110.65 126.57 54.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.126 -176.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.569 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 29.8 mt -103.75 152.86 21.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.996 -173.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.569 ' HD2' ' O ' ' A' ' 22' ' ' LEU . 2.3 mpt_? -133.94 174.59 10.31 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.502 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -89.46 122.17 32.4 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.178 178.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.27 -38.77 26.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.356 0.598 . . . . 0.0 110.206 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.49 -56.99 0.47 Allowed Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.866 -176.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -97.8 -11.0 23.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.557 0.694 . . . . 0.0 109.903 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -168.23 -166.53 27.45 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.71 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.69 ' HB2' HG23 ' A' ' 2' ' ' ILE . 42.3 m -102.39 141.83 34.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.647 0.224 . . . . 0.0 110.514 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.54 177.99 7.39 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 45.1 mt -84.66 131.43 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.624 -177.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.46 -55.24 2.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.164 0.507 . . . . 0.0 109.812 174.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.896 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 4.8 ttmp? -109.91 110.18 21.05 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.382 -176.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -105.33 112.81 26.06 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -118.06 6.06 12.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.184 0.516 . . . . 0.0 110.565 -174.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 57.4 mt -81.28 149.23 29.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.9 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -83.13 40.08 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.362 0.601 . . . . 0.0 110.7 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -128.7 152.78 79.3 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.642 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.33 156.06 67.02 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.317 2.012 . . . . 0.0 111.994 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -71.91 125.32 91.61 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.417 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 23.8 Cg_endo -61.71 159.38 33.07 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.99 2.46 . . . . 0.0 112.599 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.598 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 61.7 p -94.64 156.14 16.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.28 -178.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.0 tm0? -52.41 -45.27 65.82 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.71 0.631 . . . . 0.0 109.832 177.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.2 -51.77 68.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.608 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.7 -34.71 78.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.132 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.4 mt -54.34 -46.54 72.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.88 -26.65 59.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.2 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.8 m -63.89 -46.99 82.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.264 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.476 ' CE2' ' HD3' ' A' ' 10' ' ' LYS . 13.6 m0 -63.78 -35.45 80.65 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.08 0.467 . . . . 0.0 109.782 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -60.96 -49.22 78.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.595 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -64.11 -38.83 92.47 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.666 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.66 -48.82 77.67 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.914 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.9 tp -60.54 -22.22 63.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.128 0.49 . . . . 0.0 110.833 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -86.78 -46.14 10.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.231 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.84 -17.08 42.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -119.37 109.54 38.52 Favored Pre-proline 0 C--N 1.311 -1.098 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.844 -173.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.504 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 71.8 Cg_endo -77.49 140.7 19.35 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.689 2.259 . . . . 0.0 112.38 178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.504 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 13.0 Cg_exo -70.29 152.76 66.74 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.914 2.41 . . . . 0.0 112.045 177.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -70.33 113.6 7.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.993 0.425 . . . . 0.0 110.213 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 . . . . . 0 C--N 1.323 -0.545 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.244 -179.436 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 ppp? . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.5 mp -112.88 128.77 69.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.13 -179.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.7 mm? -67.59 -40.52 84.79 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.791 0.329 . . . . 0.0 111.376 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.523 ' CD1' HD11 ' A' ' 22' ' ' LEU . 40.4 t80 -52.62 -47.29 67.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.995 -176.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.53 -44.61 93.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.534 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.519 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -64.58 -45.82 85.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.787 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.6 mt -58.86 -48.26 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.69 178.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -26.38 68.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.846 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -69.2 -49.69 54.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.321 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.654 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 86.1 tttt -77.8 -35.76 51.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.996 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -117.8 79.84 13.6 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.852 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.445 ' HD3' ' O ' ' A' ' 10' ' ' LYS . 3.4 Cg_exo -78.38 -23.3 8.81 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.964 2.443 . . . . 0.0 112.066 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -85.19 -6.48 59.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.76 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.4 127.93 34.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.521 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.8 t -82.7 121.13 35.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.093 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.3 t -69.0 143.25 54.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.191 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HA ' ' HG2' ' A' ' 21' ' ' GLU . 81.5 mtt180 63.14 21.43 12.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.964 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -109.29 -69.64 0.85 Allowed 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.418 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -99.43 -46.21 5.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.468 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 32.8 p90 -100.68 138.16 38.12 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 175.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.463 ' CB ' ' HB3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -131.1 142.53 50.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.041 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.523 HD11 ' CD1' ' A' ' 4' ' ' TYR . 14.0 mt -101.71 144.81 29.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.842 -172.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -143.43 169.37 17.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.552 176.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 29' ' ' SER . 10.6 t30 -106.09 112.28 25.26 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.609 -176.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.591 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 30.8 t70 -79.64 -28.37 40.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.803 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 175.84 -95.44 0.1 Allowed Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.484 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -95.91 35.29 1.42 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.483 0.658 . . . . 0.0 109.789 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.77 148.9 7.12 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.97 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 24' ' ' ASN . 16.9 m -99.17 129.05 45.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.591 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -134.78 -168.68 2.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.946 0.403 . . . . 0.0 110.971 -173.114 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -81.96 132.69 30.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.174 177.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -125.23 -53.67 1.61 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 20' ' ' PHE . 58.2 tttm -94.55 122.91 37.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.875 178.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -136.47 111.01 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -118.15 3.71 12.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.249 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.7 mt -71.86 137.62 47.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -79.81 59.58 3.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.87 0.843 . . . . 0.0 110.238 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -139.76 150.58 63.4 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.136 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.57 147.85 46.59 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.187 1.925 . . . . 0.0 111.898 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.11 130.87 93.19 Favored Pre-proline 0 N--CA 1.449 -0.49 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.03 176.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.468 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 41.8 Cg_endo -68.19 168.61 18.75 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.848 2.365 . . . . 0.0 112.994 -177.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 41.1 p -104.33 165.29 11.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.546 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -57.36 -43.77 83.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.291 0.567 . . . . 0.0 109.735 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.79 -47.82 73.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.97 -1.014 . . . . 0.0 110.633 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.434 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 30.4 mt-10 -58.24 -53.42 58.48 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 176.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.8 mt -52.31 -49.09 64.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.627 -177.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.72 -33.45 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.627 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 91.8 m -64.08 -45.28 89.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.554 0.216 . . . . 0.0 110.556 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.654 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.0 m0 -63.72 -42.13 97.98 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -63.1 -44.31 96.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.801 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -62.29 -46.73 87.44 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.497 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.547 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 45.5 mt-10 -64.0 -37.35 87.1 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.861 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.9 tp -65.09 -30.03 70.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.869 0.366 . . . . 0.0 110.914 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -91.39 -39.76 11.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.091 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -88.4 -15.8 34.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.162 0.506 . . . . 0.0 111.447 -173.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.547 ' HB3' ' O ' ' A' ' 52' ' ' GLU . 9.0 t30 -110.68 122.75 37.4 Favored Pre-proline 0 C--N 1.315 -0.929 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.533 176.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 56' ' ' ASN . 11.5 Cg_exo -70.78 117.25 5.04 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.865 2.377 . . . . 0.0 112.536 -177.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 3.6 Cg_exo -75.91 138.32 20.79 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.777 2.318 . . . . 0.0 110.964 175.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -88.25 121.83 31.1 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.86 0.362 . . . . 0.0 110.62 -176.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.702 177.998 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 ttt . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.471 ' N ' HD12 ' A' ' 2' ' ' ILE . 3.9 mp -87.13 112.62 23.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.22 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.457 HD11 HD13 ' A' ' 46' ' ' LEU . 2.9 mm? -70.13 -34.36 72.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.113 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -51.17 -49.18 61.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.861 -175.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.25 -51.09 70.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.339 -177.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.72 90.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.461 -177.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 3' ' ' LEU . 77.8 mt -63.25 -47.86 90.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.249 -178.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.4 ttm -76.25 -16.99 59.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.969 0.414 . . . . 0.0 111.012 -174.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.438 ' CD2' ' HB3' ' A' ' 49' ' ' TRP . 92.4 t80 -69.38 -44.72 70.9 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 174.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -82.07 -37.21 26.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.092 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -124.17 97.74 39.91 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 121.069 0.462 . . . . 0.0 111.226 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -66.53 -27.81 45.93 Favored 'Trans proline' 0 CA--C 1.528 0.185 0 C-N-CA 122.857 2.371 . . . . 0.0 112.567 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -87.34 8.82 22.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.667 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.528 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -78.71 107.06 11.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.895 0.379 . . . . 0.0 110.526 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.67 105.83 15.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.406 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m -70.03 140.97 52.94 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.441 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 71.38 12.4 6.65 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.577 177.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -116.38 -76.48 0.57 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -91.5 -31.24 16.03 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.147 0.499 . . . . 0.0 110.415 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.528 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 17.2 p90 -127.62 135.67 50.58 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 170.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -130.51 139.96 50.5 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.464 0.649 . . . . 0.0 110.557 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.0 mt -93.61 146.86 23.51 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.493 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.428 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.9 mpt_? -130.92 169.8 15.31 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 176.07 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -92.3 117.86 30.32 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.441 -175.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -86.82 -26.24 24.16 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 132.18 -38.31 1.91 Allowed Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.03 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -87.44 -22.34 25.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.355 0.598 . . . . 0.0 110.427 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 171.02 -160.24 32.58 Favored Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.351 177.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 m -99.24 112.3 24.49 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -116.9 173.63 6.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.442 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.6 mt -69.96 114.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.248 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.428 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 1.6 tm-20 -121.1 -53.62 2.04 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.678 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.82 116.91 32.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -129.36 111.86 13.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -114.55 3.88 15.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.921 0.391 . . . . 0.0 110.813 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.8 mt -70.66 145.58 50.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.89 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -81.79 49.03 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.144 0.497 . . . . 0.0 110.396 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . . . -146.17 140.05 15.11 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.808 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 38' ' ' ALA . 38.6 Cg_exo -61.92 148.25 93.52 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.075 2.517 . . . . 0.0 112.59 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.08 142.95 90.82 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.296 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.19 171.72 16.27 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.387 2.058 . . . . 0.0 110.963 170.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.7 p -104.6 167.77 9.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.49 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -56.61 -47.95 78.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.136 0.493 . . . . 0.0 110.021 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.11 -48.88 73.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.172 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -57.39 -49.73 75.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.303 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.457 HD13 HD11 ' A' ' 3' ' ' LEU . 91.7 mt -55.59 -47.74 76.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.046 0.45 . . . . 0.0 111.184 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -75.9 -18.0 59.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.635 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.3 m -64.92 -50.08 67.88 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.438 ' HB3' ' CD2' ' A' ' 9' ' ' TYR . 8.1 m0 -67.26 -31.74 72.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.22 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -62.09 -44.77 95.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.927 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -60.8 -46.19 91.49 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.842 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.39 -35.8 81.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.915 0.388 . . . . 0.0 111.0 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.3 tp -65.42 -38.84 91.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.667 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.71 -25.37 41.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.127 0.489 . . . . 0.0 110.435 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.444 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 43.2 tttm -87.16 18.92 3.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.244 178.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 55' ' ' LYS . 11.5 t30 78.29 107.78 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.386 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.408 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.49 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 40.1 Cg_endo -68.31 128.63 17.72 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.939 2.426 . . . . 0.0 112.171 179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 9.4 Cg_exo -71.2 168.1 24.31 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.936 2.424 . . . . 0.0 112.482 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -108.35 133.34 52.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.703 177.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 . . . . . 0 C--N 1.326 -0.439 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.152 -179.114 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.4 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.421 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.4 mp -104.87 115.31 46.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.512 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.2 OUTLIER -63.44 -32.76 74.29 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.096 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.402 ' HE1' ' HB3' ' A' ' 16' ' ' SER . 22.8 t80 -52.98 -48.57 67.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.084 -176.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.6 -48.8 79.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.351 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.69 -43.78 85.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.432 178.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -67.09 -38.31 80.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.54 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.0 mmt -68.64 -22.5 64.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.481 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -79.25 -38.31 35.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.848 0.356 . . . . 0.0 110.309 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? -80.68 -50.78 9.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.96 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -118.81 85.33 27.79 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.992 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.64 -20.85 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.624 2.216 . . . . 0.0 112.879 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -90.1 -8.34 51.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.073 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.14 141.93 58.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.327 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.448 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 33.4 t -104.12 128.44 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.14 0.495 . . . . 0.0 110.738 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.402 ' HB3' ' HE1' ' A' ' 4' ' ' TYR . 3.0 p -70.67 141.81 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.321 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 43.2 mtt180 65.55 25.12 11.77 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.513 0.673 . . . . 0.0 110.705 -176.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 84.8 tttt -140.92 -60.16 0.5 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.382 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.401 ' HB3' HD21 ' A' ' 36' ' ' LEU . 33.8 m-20 -86.98 -38.36 16.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.865 176.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 p90 -152.26 149.37 28.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.043 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 66.7 tt0 -136.02 135.39 39.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.466 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 48.9 mt -117.24 155.19 29.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.863 0.363 . . . . 0.0 111.627 -170.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 29' ' ' SER . 5.6 mpt_? -124.22 173.73 8.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.017 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -98.43 119.55 37.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.655 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -81.1 -33.08 33.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.226 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.96 -36.25 3.51 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -170.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -95.33 9.41 39.97 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 173.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 134.27 -176.7 19.68 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.789 -178.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.454 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 11.1 m -84.67 130.57 34.69 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -120.42 171.43 8.54 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 110.606 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.512 HG13 ' HG ' ' A' ' 3' ' ' LEU . 62.7 mt -82.33 121.77 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.23 -176.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -108.75 -58.41 2.01 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 176.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 32.0 mmtp -99.17 131.74 44.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.516 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -133.58 111.62 10.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 175.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -114.18 1.29 14.5 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.081 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.401 HD21 ' HB3' ' A' ' 19' ' ' ASP . 76.8 mt -78.73 147.71 33.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 -177.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.7 mtp180 -87.5 36.06 0.74 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.432 177.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.23 141.1 38.81 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.006 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.79 148.73 93.05 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.826 2.35 . . . . 0.0 112.459 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.91 128.59 93.37 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.661 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.43 ' HG2' HD21 ' A' ' 46' ' ' LEU . 56.1 Cg_endo -71.23 171.67 15.57 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.546 2.164 . . . . 0.0 111.909 176.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.475 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.9 p -93.6 165.29 12.8 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.702 -177.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -59.22 -39.66 83.37 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.168 178.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.92 95.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.314 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.55 -48.48 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.879 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 42' ' ' THR . 99.7 mt -55.35 -47.2 76.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.336 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.39 -28.28 66.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.0 m -62.94 -50.76 69.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.565 0.222 . . . . 0.0 110.807 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -65.1 -38.56 91.1 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-O 120.974 0.416 . . . . 0.0 110.276 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -58.76 -49.26 78.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.714 177.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.86 -44.51 96.91 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 123.141 0.576 . . . . 0.0 111.765 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.488 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.26 -38.08 82.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.903 0.382 . . . . 0.0 110.474 177.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -69.65 -38.87 77.3 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.544 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -79.65 -13.18 59.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.898 0.38 . . . . 0.0 111.884 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 57' ' ' PRO . 84.2 m-20 -97.36 155.56 37.21 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-O 120.918 0.389 . . . . 0.0 111.721 -175.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 56' ' ' ASN . 3.8 Cg_exo -77.18 164.46 29.25 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.383 2.722 . . . . 0.0 111.603 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -67.67 146.65 73.94 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.574 2.183 . . . . 0.0 112.291 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -84.25 146.46 27.77 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 . . . . . 0 C--N 1.325 -0.474 0 O-C-N 123.229 0.33 . . . . 0.0 111.531 -178.53 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.0 mp -104.43 111.1 32.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.929 0.395 . . . . 0.0 110.151 178.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.732 ' HG ' HG13 ' A' ' 31' ' ' ILE . 2.8 mm? -70.04 -30.59 67.91 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.4 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -50.45 -40.4 50.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.79 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.401 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 23.7 m-20 -67.56 -55.3 14.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.61 -177.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.87 86.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.57 -176.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.0 mt -64.06 -44.86 97.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.268 -177.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 69.9 mtp -81.88 -9.04 59.71 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.485 -176.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -77.39 -38.9 48.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.64 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 61.9 tttm -81.35 -38.19 27.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.239 177.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.53 ' HB2' ' HB2' ' A' ' 14' ' ' ALA . 85.1 m-85 -121.08 98.58 47.16 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.536 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.77 -24.49 68.64 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.609 2.206 . . . . 0.0 111.973 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -98.53 17.86 18.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.043 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.53 ' HB2' ' HB2' ' A' ' 11' ' ' TYR . . . -86.76 101.41 13.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.141 0.496 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 37.7 t -88.79 117.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.449 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 p -72.04 150.6 43.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.468 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 64.88 23.05 12.59 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -125.05 -72.06 0.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.037 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.7 t0 -109.25 4.83 23.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.786 0.803 . . . . 0.0 110.022 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.495 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 39.6 p90 -165.27 127.18 2.07 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 171.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -113.33 130.42 56.27 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.126 0.489 . . . . 0.0 111.169 -172.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.34 153.2 24.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.667 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.508 ' NH1' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -133.32 173.96 10.91 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.246 0.546 . . . . 0.0 111.208 176.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -99.52 123.62 43.96 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.204 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.434 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 7.1 t70 -98.19 -34.64 10.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.224 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.74 -29.14 5.94 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -174.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -100.36 -8.93 22.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.611 0.72 . . . . 0.0 109.588 175.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.8 177.42 30.89 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.776 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.2 m -96.13 115.48 27.5 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.434 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 53.5 p90 -106.17 171.24 7.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.806 -172.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.732 HG13 ' HG ' ' A' ' 3' ' ' LEU . 58.5 mt -87.45 118.71 33.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.977 176.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.508 ' HG2' ' NH1' ' A' ' 23' ' ' ARG . 8.9 tp10 -101.97 -56.55 2.25 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.78 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -121.29 113.09 19.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.336 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.442 ' CH2' HD12 ' A' ' 36' ' ' LEU . 58.1 t-105 -106.83 112.53 25.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.173 -174.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 6.1 m-20 -110.86 1.94 17.94 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -177.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.442 HD12 ' CH2' ' A' ' 34' ' ' TRP . 90.7 mt -69.57 141.42 53.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.32 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -82.59 41.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.489 0.661 . . . . 0.0 110.748 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.13 142.17 40.84 Favored Pre-proline 0 C--N 1.315 -0.935 0 CA-C-N 115.104 -0.953 . . . . 0.0 108.774 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.4 155.74 50.54 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.381 2.054 . . . . 0.0 111.962 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.4 mm? -65.8 120.55 69.75 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.598 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -62.69 168.83 9.47 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.918 2.412 . . . . 0.0 112.117 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.4 p -94.1 167.03 11.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.74 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -62.57 -44.19 96.93 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.898 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.79 -45.05 86.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.208 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -57.7 -54.11 50.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.818 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.451 ' HA ' ' CE3' ' A' ' 49' ' ' TRP . 93.3 mt -55.21 -46.21 75.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.826 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.77 -20.77 59.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -177.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 88.5 m -70.83 -44.35 66.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.107 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.64 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 9.5 m0 -64.31 -36.97 85.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.424 ' O ' ' HB2' ' A' ' 54' ' ' GLN . 62.0 t-105 -60.97 -42.75 98.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.312 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -70.51 -43.39 69.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.23 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -61.8 -40.78 96.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.401 ' CD2' ' HB3' ' A' ' 5' ' ' ASP . 58.5 tp -68.38 -34.35 75.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.525 176.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' A' ' 50' ' ' TRP . 0.4 OUTLIER -72.61 -25.17 61.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.063 0.458 . . . . 0.0 110.541 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 74.5 tttt -78.65 -6.76 56.55 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.506 175.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.3 t30 71.52 109.2 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.313 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.284 -174.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.68 144.61 99.4 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.048 2.498 . . . . 0.0 112.888 -177.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.27 -177.88 1.91 Allowed 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.048 2.499 . . . . 0.0 112.401 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -60.42 120.04 9.14 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.893 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.002 -179.891 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.429 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 1.3 tmt? . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.423 HG22 ' H ' ' A' ' 4' ' ' TYR . 4.4 mp -106.28 124.52 61.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.267 -177.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.626 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 0.2 OUTLIER -65.86 -32.98 74.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.515 179.435 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.456 ' HE1' ' OG ' ' A' ' 16' ' ' SER . 81.8 t80 -52.17 -47.63 65.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.258 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.455 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 0.9 OUTLIER -60.4 -47.81 84.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.401 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.89 99.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.12 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 3' ' ' LEU . 82.1 mt -63.49 -43.25 98.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.15 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 30.6 mmt -67.71 -23.29 65.26 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.165 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -81.39 -37.7 27.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.938 0.399 . . . . 0.0 110.437 177.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -82.78 -50.81 8.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.382 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -132.33 88.02 41.13 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.467 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -68.35 -13.12 36.89 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.744 2.296 . . . . 0.0 111.3 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -75.93 -13.74 60.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.875 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.9 137.63 32.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.549 ' HB ' ' HD3' ' A' ' 18' ' ' LYS . 47.7 t -99.34 129.36 49.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.89 0.376 . . . . 0.0 110.743 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.456 ' OG ' ' HE1' ' A' ' 4' ' ' TYR . 14.9 m -62.92 134.4 56.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.253 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 70.8 3.98 4.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.533 0.733 . . . . 0.0 111.553 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.549 ' HD3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -110.96 -63.84 1.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.851 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.544 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 52.5 m-20 -90.0 -17.71 27.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.288 -177.218 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.2 p90 -153.51 130.35 10.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.517 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 33.2 tt0 -109.79 126.39 53.72 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 mt -90.77 150.85 21.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.612 0.72 . . . . 0.0 111.542 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -139.68 154.75 47.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.502 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -86.3 123.7 31.84 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.057 0.456 . . . . 0.0 110.783 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.468 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 1.7 t70 -88.86 -32.69 17.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.325 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.07 -43.61 1.52 Allowed Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -79.5 -20.03 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.451 0.644 . . . . 0.0 109.579 173.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.429 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 163.72 -172.07 39.52 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.317 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -88.19 121.66 30.84 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.626 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.3 p90 -117.94 -178.06 3.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.447 -0.205 . . . . 0.0 110.447 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.441 HD11 HD11 ' A' ' 7' ' ' ILE . 31.0 mt -91.11 121.6 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.972 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -98.65 -53.33 3.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.517 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 2.8 tppp? -94.76 104.52 16.43 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.351 178.186 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 61.5 t-105 -87.03 108.89 19.06 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 168.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -106.91 -2.97 20.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.463 0.649 . . . . 0.0 110.41 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.544 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 73.2 mt -86.95 147.62 25.68 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.873 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.2 mtp180 -92.57 36.2 1.01 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.474 ' HB1' ' HD2' ' A' ' 39' ' ' PRO . . . -111.2 161.74 23.83 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 114.41 -1.268 . . . . 0.0 109.943 -177.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' 38' ' ' ALA . 30.8 Cg_endo -64.39 150.05 88.97 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.642 2.228 . . . . 0.0 112.468 178.389 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.58 134.08 51.64 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.898 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.412 ' HB3' ' CH2' ' A' ' 49' ' ' TRP . 43.0 Cg_endo -68.97 164.37 33.98 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.487 2.125 . . . . 0.0 111.375 172.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.604 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 70.3 p -95.87 167.63 11.13 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.704 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -55.88 -46.81 78.22 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.343 0.592 . . . . 0.0 109.534 173.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.75 70.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.847 176.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.01 -46.62 87.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.415 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 42' ' ' THR . 87.4 mt -57.08 -44.52 83.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.909 0.385 . . . . 0.0 111.023 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -75.02 -24.64 58.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.056 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.8 m -73.07 -41.43 64.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.398 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.412 ' CH2' ' HB3' ' A' ' 41' ' ' PRO . 51.2 m0 -66.58 -31.98 73.03 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -64.46 -36.11 83.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.944 174.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.11 -50.25 49.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.295 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -62.22 -32.79 73.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.694 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.455 ' CD2' ' HB3' ' A' ' 5' ' ' ASP . 44.9 tp -61.11 -43.06 99.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.036 176.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -76.65 -31.62 57.45 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.491 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -74.01 -15.17 61.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.892 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -148.35 80.19 8.6 Favored Pre-proline 0 C--N 1.317 -0.811 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.3 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -71.94 161.89 43.54 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.924 2.416 . . . . 0.0 112.799 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -53.51 149.02 32.32 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 122.885 2.39 . . . . 0.0 111.854 176.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -64.86 125.25 24.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.177 0.513 . . . . 0.0 111.214 -173.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 . . . . . 0 C--N 1.323 -0.578 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.008 178.981 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.456 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.601 HG23 ' HB2' ' A' ' 29' ' ' SER . 4.2 mp -108.47 128.86 63.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.208 -177.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.45 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -66.12 -32.55 74.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.399 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.508 ' H ' HG22 ' A' ' 2' ' ' ILE . 84.3 t80 -52.39 -45.56 65.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.685 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.36 -49.94 75.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 0.0 111.201 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.32 -45.08 95.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.295 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.29 -47.08 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.888 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.26 -29.64 70.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.83 -177.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -68.23 -45.34 73.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.048 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 10' ' ' LYS . 21.9 tptm -81.17 -35.8 30.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.887 -178.127 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -121.72 89.03 47.51 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.554 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -66.39 -22.01 53.05 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.983 2.455 . . . . 0.0 112.336 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -102.8 23.99 11.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.235 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.53 106.28 18.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.596 HG11 ' HD2' ' A' ' 18' ' ' LYS . 19.5 t -76.47 113.59 15.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.153 0.502 . . . . 0.0 111.201 -175.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.3 p -66.81 139.01 57.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.742 -178.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 68.8 6.93 5.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.448 -0.797 . . . . 0.0 112.099 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.596 ' HD2' HG11 ' A' ' 15' ' ' VAL . 50.1 mttp -119.18 -55.49 2.15 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.842 0.353 . . . . 0.0 110.265 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.455 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 10.7 t70 -91.66 -50.32 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.95 178.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -120.27 141.08 50.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.646 176.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.647 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 80.4 tt0 -129.51 131.09 46.55 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -177.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 mt -112.53 153.54 27.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.796 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.416 ' HD3' ' HA ' ' A' ' 23' ' ' ARG . 9.7 tpp180 -123.12 157.01 33.83 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.421 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -98.97 132.09 44.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.085 0.469 . . . . 0.0 111.357 -171.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -90.97 -48.3 7.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.689 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.55 -47.37 0.93 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -173.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -92.4 6.19 47.92 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.654 0.74 . . . . 0.0 109.695 174.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.456 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 161.93 -164.92 35.59 Favored Glycine 0 N--CA 1.441 -0.977 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.674 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.601 ' HB2' HG23 ' A' ' 2' ' ' ILE . 18.4 m -130.16 136.34 49.17 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 46.4 p90 -120.6 173.1 7.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.986 -173.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.45 HG13 ' HG ' ' A' ' 3' ' ' LEU . 29.7 mt -95.78 137.25 24.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.507 -175.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -129.46 -22.96 2.98 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.831 0.348 . . . . 0.0 111.184 167.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.647 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 20.7 mmtp -117.15 135.7 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.417 177.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -154.43 111.67 3.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -110.39 -9.97 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.783 179.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.455 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 69.5 mt -56.62 133.27 53.59 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.174 0.512 . . . . 0.0 111.372 -178.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -80.84 51.44 1.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.384 -178.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.18 144.42 31.52 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.159 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.29 148.06 93.9 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.725 2.283 . . . . 0.0 112.3 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.2 mm? -65.28 133.77 95.6 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.944 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.63 169.21 21.59 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.974 2.449 . . . . 0.0 112.201 178.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.527 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 23.4 p -99.96 166.83 10.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -62.89 -39.03 93.25 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.53 91.14 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.423 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.88 -44.53 96.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.884 177.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 42' ' ' THR . 98.6 mt -59.74 -44.25 93.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.849 178.351 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 43' ' ' GLN . 53.3 mt-10 -60.94 -40.21 92.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.008 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.401 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 7.9 m -64.82 -48.12 75.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.47 -177.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -62.8 -35.03 78.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.152 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.521 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -61.5 -53.26 58.79 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.83 -43.53 90.71 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 48' ' ' THR . 42.4 mt-10 -58.77 -46.62 87.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.883 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 55.4 tp -62.27 -31.85 72.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.213 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.6 mm-40 -79.98 -39.19 30.61 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.502 -178.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -84.29 -16.91 41.37 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -95.82 154.87 38.95 Favored Pre-proline 0 C--N 1.311 -1.09 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.695 -179.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.06 126.76 21.13 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.475 2.117 . . . . 0.0 111.183 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.12 169.17 9.61 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.677 2.252 . . . . 0.0 112.907 -176.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -57.72 117.03 3.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.486 -178.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.376 -179.742 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.484 1.264 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.4 mp -106.34 106.4 20.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.994 0.426 . . . . 0.0 110.342 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.6 mm? -70.79 -32.67 69.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.41 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -51.37 -54.21 28.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.431 -175.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.404 ' HB2' ' HZ3' ' A' ' 50' ' ' TRP . 5.7 m-20 -63.89 -47.84 79.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.49 -179.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.51 -49.53 74.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -69.11 -42.05 81.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.122 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 tpt -63.74 -35.37 80.36 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.965 0.412 . . . . 0.0 110.816 -177.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -70.82 -43.66 68.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.129 178.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.427 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 6.3 tmtm? -70.72 -47.22 60.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.741 -176.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.427 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 80.3 m-85 -120.64 92.39 47.85 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.296 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -63.87 -27.56 67.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.463 2.109 . . . . 0.0 112.396 -178.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -94.27 12.75 25.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.424 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.88 122.35 33.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.192 0.52 . . . . 0.0 110.156 175.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -100.27 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.148 -176.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.43 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 9.2 p -84.07 39.96 0.73 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 122.003 0.906 . . . . 0.0 111.474 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.476 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 77.2 mtt180 -95.49 -72.59 0.62 Allowed 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.315 176.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.476 ' HD2' ' HB3' ' A' ' 17' ' ' ARG . 3.3 mptp? -114.66 -37.09 4.34 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.6 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.31 -44.15 88.45 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.825 0.822 . . . . 0.0 109.957 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.43 ' O ' ' HA ' ' A' ' 16' ' ' SER . 20.4 p90 -148.92 149.04 30.54 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 168.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -136.7 133.02 35.68 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.263 0.554 . . . . 0.0 110.958 -174.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.3 mt -94.85 153.92 17.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.116 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -135.22 154.21 51.66 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -178.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -75.24 123.74 25.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.548 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 11.7 t70 -87.35 -28.35 22.27 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.715 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.15 -43.56 1.69 Allowed Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 -173.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -100.31 10.67 40.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.977 0.894 . . . . 0.0 109.099 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.14 -160.55 30.53 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.779 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.507 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 19.3 m -130.92 121.51 25.31 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.548 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -125.74 -179.17 4.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.841 0.353 . . . . 0.0 110.924 -173.548 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.3 mt -84.04 118.99 32.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.144 0.497 . . . . 0.0 111.318 -175.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -90.14 -56.22 3.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.002 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -115.84 148.4 39.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.885 -178.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -150.44 111.39 4.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.267 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -120.05 7.38 10.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.044 0.45 . . . . 0.0 110.505 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.3 147.6 51.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -86.88 51.15 2.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.619 0.723 . . . . 0.0 109.983 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.32 146.33 57.51 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.302 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.45 136.61 77.06 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.865 2.377 . . . . 0.0 112.581 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.85 116.94 24.12 Favored Pre-proline 0 C--N 1.333 -0.138 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -60.47 151.0 78.09 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.672 2.248 . . . . 0.0 112.164 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.5 p -99.34 175.43 5.87 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.416 -178.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -53.79 -52.29 60.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.174 0.511 . . . . 0.0 110.759 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.63 -48.1 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -58.92 -49.94 75.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.496 HD22 HD11 ' A' ' 3' ' ' LEU . 80.2 mt -57.87 -49.11 77.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.207 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 42.4 mt-10 -69.15 -33.53 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.833 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -62.48 -41.9 99.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.682 0.277 . . . . 0.0 110.883 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -66.83 -35.2 79.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 110.257 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.404 ' HZ3' ' HB2' ' A' ' 5' ' ' ASP . 76.9 t-105 -66.66 -40.89 88.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.964 174.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.0 mt-10 -63.21 -43.9 96.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.264 177.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 39.0 mt-10 -62.33 -40.34 96.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.443 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 tp -65.94 -40.42 91.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.053 0.454 . . . . 0.0 110.454 176.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -66.0 -32.08 73.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.376 0.608 . . . . 0.0 110.615 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 46.5 tttm -100.06 14.23 31.35 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.856 -178.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 64.0 t30 -100.12 127.4 33.46 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 122.145 -0.347 . . . . 0.0 111.175 -177.129 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.467 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 24.6 Cg_exo -64.07 135.27 46.59 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.406 2.071 . . . . 0.0 110.106 167.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 31.7 Cg_exo -56.93 146.26 80.52 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.752 2.302 . . . . 0.0 113.361 -172.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -81.74 109.43 16.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.468 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.464 -177.366 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.6 mp -104.79 112.59 39.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.898 0.38 . . . . 0.0 110.434 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.51 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.6 mm? -70.41 -32.56 70.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.805 -178.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.499 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . 70.0 t80 -49.89 -52.42 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.74 -173.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.546 ' HB3' HD13 ' A' ' 53' ' ' LEU . 6.2 m-20 -66.76 -49.39 66.08 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.855 -177.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.23 -44.54 75.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.824 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 3' ' ' LEU . 73.2 mt -66.95 -48.83 78.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.694 -176.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.2 mtp -74.37 -22.26 59.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.161 -174.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -71.98 -37.81 69.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.093 0.473 . . . . 0.0 110.19 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -79.21 -48.92 13.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.993 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -116.14 101.17 53.94 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.914 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.41 -14.5 28.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.771 2.314 . . . . 0.0 112.369 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -94.13 4.97 53.15 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.219 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -100.69 117.73 35.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.757 0.313 . . . . 0.0 110.441 -177.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.565 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 45.3 t -95.77 129.29 46.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.832 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -68.15 139.49 56.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.0 mtt-85 66.54 6.06 4.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.59 -177.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.565 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -109.95 -64.95 1.2 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.487 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 46.2 m-20 -93.08 -25.64 17.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.913 -176.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.505 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 44.9 p90 -147.91 131.82 17.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.427 177.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.852 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 31.2 tt0 -120.06 134.97 55.1 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.499 ' CD1' ' HB2' ' A' ' 4' ' ' TYR . 35.9 mt -95.79 153.67 17.62 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.656 -170.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.0 162.8 34.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.648 175.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 -100.16 135.4 41.65 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 120.835 0.35 . . . . 0.0 110.647 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.422 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 12.9 t70 -99.39 -42.01 7.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.289 0.566 . . . . 0.0 109.996 175.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.45 -63.22 0.16 Allowed Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 -178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -112.0 17.4 19.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.584 0.706 . . . . 0.0 110.104 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -170.52 163.87 37.09 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.873 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.436 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 16.3 m -115.92 116.17 27.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 19.8 p90 -113.55 -175.96 2.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.587 -175.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 mt -89.96 126.48 42.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.799 0.333 . . . . 0.0 111.649 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -104.9 -56.17 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 172.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.852 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 17.3 mmtm -85.91 104.27 15.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.928 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.402 ' CH2' HD12 ' A' ' 36' ' ' LEU . 28.9 t-105 -101.95 112.34 24.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 174.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.487 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 16.3 m120 -116.39 17.24 15.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.288 -175.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.402 HD12 ' CH2' ' A' ' 34' ' ' TRP . 87.9 mt -106.67 149.62 27.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.395 179.186 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -89.46 35.93 0.83 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.293 0.568 . . . . 0.0 110.064 177.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . . . -114.51 141.8 27.17 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.345 -176.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 38' ' ' ALA . 22.0 Cg_exo -64.57 141.92 75.43 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 123.109 2.539 . . . . 0.0 111.852 175.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 4.0 mm? -66.75 138.37 95.34 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.583 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 40' ' ' LEU . 6.2 Cg_exo -77.39 -174.84 2.37 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.22 2.614 . . . . 0.0 112.248 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.471 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 82.1 p -105.04 170.86 7.63 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.442 -178.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.27 -48.08 81.49 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.144 0.278 . . . . 0.0 110.922 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.47 -44.09 72.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.04 -55.17 38.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.398 177.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.5 mt -56.41 -47.14 79.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.9 -29.54 67.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.089 -176.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 87.9 m -67.24 -44.2 80.02 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.376 178.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.437 ' CZ3' HD23 ' A' ' 46' ' ' LEU . 25.3 m0 -60.82 -45.17 95.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.157 0.503 . . . . 0.0 109.88 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.4 t-105 -59.27 -47.92 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.771 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.04 -41.46 95.19 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.167 -0.469 . . . . 0.0 112.243 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -60.12 -40.87 91.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.768 0.318 . . . . 0.0 110.713 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.546 HD13 ' HB3' ' A' ' 5' ' ' ASP . 9.9 tt -64.96 -42.19 94.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.778 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -69.01 -35.89 77.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.274 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -92.18 6.56 46.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.032 -175.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.403 ' OD1' ' HD2' ' A' ' 57' ' ' PRO . 54.3 t30 -93.32 129.76 37.92 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.824 178.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.403 ' HD2' ' OD1' ' A' ' 56' ' ' ASN . 77.1 Cg_exo -50.59 160.21 1.8 Allowed 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 123.157 2.571 . . . . 0.0 112.472 174.669 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.24 157.36 17.95 Favored 'Trans proline' 0 C--O 1.238 0.491 0 C-N-CA 123.147 2.564 . . . . 0.0 113.382 -175.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -82.16 143.15 31.63 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.995 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 . . . . . 0 C--O 1.238 0.453 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.604 178.259 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.4 HG22 ' HB3' ' A' ' 4' ' ' TYR . 3.1 mp -113.44 116.71 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.13 -32.35 73.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.926 0.393 . . . . 0.0 110.823 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.4 ' HB3' HG22 ' A' ' 2' ' ' ILE . 87.8 t80 -52.27 -48.42 65.3 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.1 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -61.63 -51.27 69.18 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.524 -178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.92 -46.35 88.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.569 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.407 HG21 ' CZ ' ' A' ' 20' ' ' PHE . 84.4 mt -67.65 -46.26 83.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.966 -178.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.478 ' HE2' ' HA ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -66.03 -31.66 72.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.005 0.431 . . . . 0.0 110.694 -176.933 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.429 ' OH ' ' HB3' ' A' ' 52' ' ' GLU . 13.5 t80 -63.76 -51.64 63.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.112 177.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.4 tttp -81.75 -43.11 18.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.616 -174.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -123.03 94.08 47.61 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.937 0.398 . . . . 0.0 110.708 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.466 ' HA ' ' HE2' ' A' ' 8' ' ' MET . 61.2 Cg_endo -73.77 -18.11 22.34 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.675 2.25 . . . . 0.0 112.5 -177.494 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.39 1.73 43.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.295 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.445 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -87.26 143.47 27.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.1 0.476 . . . . 0.0 111.054 -179.099 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.443 HG12 ' H ' ' A' ' 17' ' ' ARG . 98.7 t -127.32 123.14 61.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.449 177.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -88.96 37.43 0.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.713 0.768 . . . . 0.0 111.475 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.443 ' H ' HG12 ' A' ' 15' ' ' VAL . 20.7 mtp180 -99.23 -55.86 2.57 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.596 170.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -105.47 -67.32 0.93 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.904 -168.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.537 ' HB3' HD21 ' A' ' 36' ' ' LEU . 3.9 m-20 -52.48 -39.69 61.48 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.54 -175.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.445 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 37.8 p90 -158.17 176.96 11.82 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 45.1 tt0 -152.47 148.8 27.84 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.931 0.396 . . . . 0.0 110.468 179.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 31' ' ' ILE . 17.2 mt -116.7 145.53 43.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.678 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.531 ' HD2' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mtt180 -141.99 148.44 38.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.256 0.551 . . . . 0.0 110.832 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -92.98 121.97 34.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.921 -175.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.75 -47.01 6.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.504 179.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.06 -35.25 1.86 Allowed Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -76.63 -25.56 53.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.921 0.867 . . . . 0.0 108.928 169.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 165.34 -175.09 41.19 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.251 -1.34 . . . . 0.0 111.549 -179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.5 m -108.35 108.97 20.17 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -121.66 -177.57 3.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.716 0.293 . . . . 0.0 111.315 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.427 ' HA ' HD23 ' A' ' 22' ' ' LEU . 13.2 mt -84.72 124.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.741 -175.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.531 ' HG2' ' HD2' ' A' ' 23' ' ' ARG . 0.6 OUTLIER -113.21 -18.92 11.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.849 0.357 . . . . 0.0 110.978 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.623 ' HZ2' ' HB2' ' A' ' 33' ' ' LYS . 3.8 ttmp? -126.38 140.81 52.21 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.0 t-105 -153.68 113.49 3.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.615 0.245 . . . . 0.0 110.624 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -117.79 -1.84 11.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.013 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 19' ' ' ASP . 88.0 mt -73.91 152.12 40.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.659 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.9 mtt180 -85.88 45.99 1.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.943 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.43 139.75 30.49 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.369 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.12 145.52 67.2 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.411 2.074 . . . . 0.0 111.469 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.2 mm? -65.7 127.38 93.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.782 -179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.432 ' HG2' HD21 ' A' ' 46' ' ' LEU . 30.5 Cg_endo -63.68 164.55 20.88 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.875 2.383 . . . . 0.0 112.028 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 p -97.2 172.29 7.9 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.342 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -50.43 -55.2 16.86 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.093 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.85 77.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.135 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.86 -44.8 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.449 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.432 HD21 ' HG2' ' A' ' 41' ' ' PRO . 92.6 mt -61.55 -43.72 98.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.972 0.415 . . . . 0.0 111.21 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.27 -29.02 64.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.294 -178.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.1 m -62.98 -44.59 95.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.655 177.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.7 m0 -68.17 -37.45 81.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.419 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.584 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 66.4 t-105 -60.89 -49.4 77.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.788 174.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -58.32 -41.8 85.35 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.489 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.429 ' HB3' ' OH ' ' A' ' 9' ' ' TYR . 79.7 mt-10 -62.35 -45.51 92.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.012 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.425 HD13 ' HB2' ' A' ' 9' ' ' TYR . 67.3 tp -60.14 -32.77 71.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.787 0.327 . . . . 0.0 111.052 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.4 mm-40 -81.26 -40.57 23.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.815 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -85.17 -17.88 35.84 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.341 0.591 . . . . 0.0 112.39 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 57' ' ' PRO . 93.4 m-20 -99.37 143.53 26.6 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.826 -177.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 56' ' ' ASN . 41.4 Cg_exo -57.21 138.55 86.74 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.773 2.316 . . . . 0.0 111.223 175.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.84 173.49 11.85 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.439 2.093 . . . . 0.0 112.795 -177.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -49.18 123.42 7.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.606 174.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.123 -176.888 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ttt . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.658 0.266 . . . . 0.0 110.717 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.438 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.1 mp -95.85 106.02 17.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.707 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.4 mm? -71.42 -32.77 68.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.33 -175.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.435 ' CD1' HD11 ' A' ' 22' ' ' LEU . 87.0 t80 -51.35 -51.8 51.25 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.945 -174.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.85 -46.8 86.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.982 0.42 . . . . 0.0 111.065 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.511 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -61.76 -47.09 86.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.596 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.8 mt -65.83 -42.14 91.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.489 ' HE2' ' HA ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -63.81 -28.69 70.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.432 178.929 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -71.15 -36.62 72.12 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.963 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.627 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 85.1 tttt -86.85 -36.75 18.28 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.239 -179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -129.55 88.96 48.44 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.787 0.327 . . . . 0.0 111.054 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.489 ' HA ' ' HE2' ' A' ' 8' ' ' MET . 73.0 Cg_endo -77.24 -21.35 11.97 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.709 2.272 . . . . 0.0 113.146 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.56 5.99 45.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.428 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.22 147.1 23.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.542 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 38.9 t -95.32 128.29 46.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.019 0.438 . . . . 0.0 111.058 -176.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.6 m -61.68 138.54 58.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.812 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.532 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 0.7 OUTLIER 69.95 -3.82 1.64 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.571 0.748 . . . . 0.0 111.92 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.542 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 61.6 tttp -112.17 -61.12 1.76 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.777 0.322 . . . . 0.0 110.426 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.413 ' HB3' HD21 ' A' ' 36' ' ' LEU . 28.6 m-20 -85.91 -37.17 19.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.379 0.609 . . . . 0.0 109.974 177.313 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -134.07 114.42 13.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.947 173.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.557 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 43.7 tt0 -96.54 141.56 29.68 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.488 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.435 HD11 ' CD1' ' A' ' 4' ' ' TYR . 44.1 mt -107.59 153.3 23.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.097 0.475 . . . . 0.0 111.589 -172.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.608 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 29.7 ttt180 -132.65 122.35 24.54 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.826 174.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.434 ' HA ' ' HA ' ' A' ' 29' ' ' SER . 47.5 t30 -97.19 116.02 28.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.186 0.517 . . . . 0.0 110.675 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -95.56 -11.62 27.05 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.557 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.52 -47.26 1.07 Allowed Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 -174.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -71.49 -17.39 62.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.732 0.777 . . . . 0.0 109.794 174.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 164.95 161.75 14.56 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.999 178.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' ASN . 19.7 m -99.76 108.72 21.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.707 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 43.0 p90 -111.71 -168.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.685 0.279 . . . . 0.0 111.117 -176.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -76.54 122.99 32.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.087 0.47 . . . . 0.0 111.833 -174.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.608 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 9.2 tp10 -96.06 -61.67 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.157 172.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.557 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -119.98 119.04 32.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.115 -176.526 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -99.55 111.07 23.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -115.51 11.32 15.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.49 0.662 . . . . 0.0 110.1 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.413 HD21 ' HB3' ' A' ' 19' ' ' ASP . 84.2 mt -89.73 140.03 29.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -82.65 44.93 0.93 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.476 0.655 . . . . 0.0 110.351 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.05 147.3 65.29 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.417 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -55.5 145.15 70.39 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 123.016 2.477 . . . . 0.0 112.654 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.74 125.02 85.43 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.155 177.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.415 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 13.2 Cg_endo -58.58 147.35 87.28 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.912 2.408 . . . . 0.0 113.087 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.429 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.7 p -83.49 157.98 22.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.208 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -57.43 -42.85 83.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.12 0.486 . . . . 0.0 110.296 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.49 -51.85 66.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.412 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.69 -42.45 98.01 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.662 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.46 HD22 HD11 ' A' ' 3' ' ' LEU . 90.5 mt -54.26 -53.52 52.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.198 177.085 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -71.22 -18.99 62.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.627 -177.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 95.0 m -70.97 -46.69 61.9 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 174.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.627 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.7 m0 -61.5 -40.72 95.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.995 0.426 . . . . 0.0 109.876 177.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -60.11 -44.38 94.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.376 176.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -60.53 -49.48 77.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.457 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -63.68 -35.69 81.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.727 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.547 ' HA ' ' HD3' ' A' ' 57' ' ' PRO . 36.1 tp -63.99 -45.7 87.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.643 175.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -69.75 -27.97 65.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.024 0.44 . . . . 0.0 111.185 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -84.4 1.28 46.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.1 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.5 t30 63.45 99.0 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.337 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.012 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.547 ' HD3' ' HA ' ' A' ' 53' ' ' LEU . 76.0 Cg_endo -79.42 147.43 20.16 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.826 2.351 . . . . 0.0 112.074 -178.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.01 154.06 52.63 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.283 1.989 . . . . 0.0 112.292 178.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -70.84 132.87 45.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.573 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 C--N 1.33 -0.27 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 -179.641 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 120.576 0.227 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 30.4 mm -88.57 107.06 17.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 110.331 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.742 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.1 mm? -70.13 -35.57 74.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.873 0.368 . . . . 0.0 110.789 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.497 ' HB2' HD13 ' A' ' 22' ' ' LEU . 71.3 t80 -52.46 -50.65 62.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.924 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.473 ' OD1' HD11 ' A' ' 53' ' ' LEU . 0.7 OUTLIER -65.83 -38.36 88.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -174.873 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.54 -44.29 78.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.018 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 3' ' ' LEU . 87.9 mt -61.65 -49.21 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.427 179.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -69.56 -22.73 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.84 -177.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -67.66 -41.98 82.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -92.01 -40.11 11.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.255 -178.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -119.26 97.05 50.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.097 -176.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -74.61 -13.66 22.3 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.555 2.17 . . . . 0.0 111.419 175.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -87.4 2.2 51.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.441 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -87.3 105.35 17.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.958 0.409 . . . . 0.0 110.815 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.1 t -81.9 117.74 28.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.774 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m -69.36 149.87 47.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.578 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 64.83 22.41 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.525 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -146.06 -72.36 0.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.084 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.554 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 4.4 m-20 -80.41 -17.42 51.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.356 0.598 . . . . 0.0 110.429 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.441 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 40.3 p90 -160.07 144.81 14.79 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.092 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -118.91 131.21 56.04 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.729 0.3 . . . . 0.0 110.196 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' A' ' 4' ' ' TYR . 29.0 mt -102.77 153.35 20.25 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.457 ' O ' ' HA ' ' A' ' 29' ' ' SER . 4.1 mtt180 -137.4 148.24 46.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.675 174.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -89.33 126.88 35.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.222 -174.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.72 -13.07 16.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.54 -33.72 6.15 Favored Glycine 0 N--CA 1.453 -0.216 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -172.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -87.93 2.45 51.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.07 0.938 . . . . 0.0 109.1 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 130.86 176.12 14.29 Favored Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.449 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.457 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 19.3 m -104.69 122.5 45.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.767 0.317 . . . . 0.0 110.269 177.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.742 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 2.9 p90 -120.61 -179.75 4.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.353 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.83 120.68 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.416 -173.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -94.09 -58.33 2.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.165 0.507 . . . . 0.0 109.707 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -115.67 145.88 42.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.973 -178.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.2 t-105 -128.02 111.93 14.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.114 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -113.7 -2.83 13.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 -179.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.554 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 34.7 mt -66.02 140.75 58.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -84.85 39.53 0.76 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.683 0.754 . . . . 0.0 110.197 178.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -123.36 154.71 65.81 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.961 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -69.48 151.41 70.69 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.082 1.855 . . . . 0.0 112.222 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.0 mm? -71.24 116.66 49.24 Favored Pre-proline 0 N--CA 1.45 -0.467 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.17 175.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.408 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 33.3 Cg_endo -65.32 159.58 46.61 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.513 2.142 . . . . 0.0 112.224 178.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.2 p -92.29 167.58 11.91 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.45 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -55.5 -45.98 77.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.154 0.502 . . . . 0.0 110.005 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.84 91.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.178 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.3 -43.68 96.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.075 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.5 mt -60.17 -46.93 88.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.181 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -68.89 -24.44 64.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.338 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.9 m -63.68 -50.8 67.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.814 0.34 . . . . 0.0 110.779 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.408 ' HH2' ' HB3' ' A' ' 41' ' ' PRO . 8.8 m0 -70.46 -32.16 69.6 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.181 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -64.93 -41.85 95.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.783 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.38 -51.08 71.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.194 175.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -63.96 -30.84 71.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.071 0.462 . . . . 0.0 111.231 -178.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.473 HD11 ' OD1' ' A' ' 5' ' ' ASP . 6.6 tt -65.93 -38.25 88.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.154 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.74 -32.58 20.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.552 -178.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.99 -15.62 58.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.379 0.609 . . . . 0.0 110.578 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -139.77 87.94 12.54 Favored Pre-proline 0 C--N 1.315 -0.911 0 CA-C-N 115.013 -0.994 . . . . 0.0 108.854 171.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.49 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 19.9 Cg_endo -60.34 145.2 99.11 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.27 2.646 . . . . 0.0 113.029 -173.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 24.6 Cg_exo -63.94 167.92 13.1 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 123.021 2.481 . . . . 0.0 111.782 176.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -109.73 121.04 44.31 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.376 -177.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.227 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.554 ' H ' HD12 ' A' ' 2' ' ' ILE . 4.1 mp -74.0 106.35 3.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.489 ' HG ' HG13 ' A' ' 31' ' ' ILE . 2.5 mm? -64.49 -34.96 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.731 -173.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -51.23 -47.02 62.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.479 -175.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -68.87 -51.23 42.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.986 0.422 . . . . 0.0 110.884 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.479 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -57.1 -45.74 83.16 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.058 -178.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.8 mt -65.69 -41.91 91.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -177.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 61.0 mtp -72.84 -19.14 61.37 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.101 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -74.65 -33.58 62.55 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 173.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -75.97 -54.45 6.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.679 178.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -120.69 91.95 47.58 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -63.43 -24.37 71.0 Favored 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.733 2.289 . . . . 0.0 112.817 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -93.76 10.67 32.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.809 0.338 . . . . 0.0 111.634 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -92.43 127.75 38.04 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.1 t -96.7 117.58 41.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-O 121.019 0.438 . . . . 0.0 111.192 -176.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -67.19 142.44 56.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 67.23 22.6 9.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.651 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -140.68 -69.41 0.39 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.065 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -93.35 -34.96 13.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.363 0.601 . . . . 0.0 109.609 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -130.47 132.27 45.58 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 170.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.614 ' HB2' ' HB3' ' A' ' 33' ' ' LYS . 49.0 mt-10 -114.19 127.8 56.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 121.265 0.555 . . . . 0.0 111.013 -175.036 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.466 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 25.5 mt -109.43 149.71 29.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.432 178.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.533 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mpt_? -130.7 164.66 24.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.903 0.382 . . . . 0.0 110.756 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -82.7 125.0 30.74 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.938 -174.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.428 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 15.8 t70 -91.1 -52.3 4.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.423 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 154.09 -35.32 0.72 Allowed Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.206 -176.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -121.4 34.45 5.19 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.83 179.78 17.11 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.788 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.8 m -113.21 137.53 51.33 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.428 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 21.7 p90 -121.6 175.57 6.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.727 0.299 . . . . 0.0 111.029 -176.135 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.489 HG13 ' HG ' ' A' ' 3' ' ' LEU . 39.9 mt -81.74 122.46 36.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.91 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.533 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -116.84 -33.05 4.91 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.569 175.324 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.614 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -124.18 133.08 53.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.55 0.214 . . . . 0.0 110.428 -179.019 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -134.34 109.49 8.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -108.25 -1.56 20.05 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.913 0.387 . . . . 0.0 110.711 -176.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.19 143.87 56.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.672 175.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -90.25 34.34 0.87 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.475 0.655 . . . . 0.0 109.949 -179.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -125.02 144.65 47.78 Favored Pre-proline 0 C--N 1.316 -0.888 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.739 -178.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -61.0 150.88 81.97 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.688 2.259 . . . . 0.0 112.287 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -66.41 139.76 96.35 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.656 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.97 166.12 19.45 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.846 2.364 . . . . 0.0 112.608 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.48 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 77.8 p -89.02 158.0 18.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.203 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -57.29 -43.58 83.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.281 0.562 . . . . 0.0 109.749 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.38 76.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.742 -1.117 . . . . 0.0 111.584 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.39 -41.35 96.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.745 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 42' ' ' THR . 95.8 mt -51.39 -50.0 60.45 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 111.132 176.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -62.23 -41.83 98.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.735 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.8 m -65.31 -34.69 78.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.378 -177.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.479 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 52.5 m0 -59.97 -45.86 91.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.022 0.439 . . . . 0.0 109.843 175.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 -62.45 -40.57 97.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.265 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.49 -50.29 73.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.069 177.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.06 -43.43 98.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.214 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.97 -36.0 82.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.508 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -34.35 33.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.243 -178.334 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -86.94 -11.05 51.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -57.23 126.88 75.39 Favored Pre-proline 0 C--N 1.315 -0.909 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.326 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -52.54 156.02 9.22 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.905 2.404 . . . . 0.0 112.38 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -41.95 136.85 3.33 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.857 3.038 . . . . 0.0 113.285 -177.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -70.54 127.79 33.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.396 -177.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 121.307 0.575 . . . . 0.0 110.448 177.988 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.469 HG22 ' H ' ' A' ' 4' ' ' TYR . 3.8 mp -117.72 132.4 67.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.809 -179.156 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.402 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.9 mm? -59.66 -34.47 72.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.919 0.39 . . . . 0.0 111.579 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.469 ' H ' HG22 ' A' ' 2' ' ' ILE . 62.0 t80 -52.95 -53.24 52.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -60.86 -48.16 83.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.264 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.421 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -58.34 -51.0 71.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.614 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 3' ' ' LEU . 75.8 mt -62.39 -42.74 96.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.763 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -24.96 65.51 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.882 -176.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -72.21 -45.22 61.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.878 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.717 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 46.1 tttp -72.94 -49.86 26.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.66 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -115.62 94.8 41.56 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.888 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -67.54 -17.57 48.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.832 2.354 . . . . 0.0 111.814 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -95.85 9.51 40.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.909 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.868 ' HB1' ' HZ ' ' A' ' 20' ' ' PHE . . . -82.01 140.72 33.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.125 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.465 ' C ' ' H ' ' A' ' 17' ' ' ARG . 43.4 t -107.45 87.15 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.167 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 m -83.48 37.81 0.59 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 122.324 1.059 . . . . 0.0 109.581 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 15' ' ' VAL . 51.9 mtt180 -96.07 -53.96 3.47 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 113.517 -1.674 . . . . 0.0 111.137 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -145.05 -45.78 0.23 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.152 -163.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -61.94 -27.7 69.01 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.723 0.773 . . . . 0.0 109.514 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.868 ' HZ ' ' HB1' ' A' ' 14' ' ' ALA . 35.4 p90 -155.89 149.04 24.48 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.374 167.062 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 31.8 tt0 -145.04 146.11 31.74 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.301 -170.392 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 39.0 mt -97.34 151.93 19.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.3 mpt_? -136.75 168.4 19.6 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.227 175.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -87.58 126.01 34.69 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.47 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 19.9 t70 -102.22 -15.53 16.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.299 0.571 . . . . 0.0 109.99 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.43 -53.34 0.8 Allowed Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.64 10.25 21.26 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.302 0.572 . . . . 0.0 109.924 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 144.18 -170.76 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.234 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 40.2 m -102.1 123.84 46.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.829 0.347 . . . . 0.0 110.607 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.47 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.2 p90 -122.7 177.81 5.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.355 -176.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.4 mt -75.38 121.05 26.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.226 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.51 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 26.3 tt0 -122.21 -46.08 2.2 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.987 177.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 32.5 mtmt -89.82 131.55 35.71 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -151.2 110.72 3.99 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -175.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -107.11 1.86 24.49 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.525 -175.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.7 mt -91.65 145.93 24.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.453 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 37' ' ' ARG . 58.5 mtt180 -83.22 48.02 1.33 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.757 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.97 145.86 55.48 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.49 -178.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.93 145.16 61.04 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.344 2.03 . . . . 0.0 111.305 174.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.89 134.02 95.93 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.596 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.79 158.95 22.45 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.487 2.791 . . . . 0.0 112.924 -178.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 59.9 p -88.64 158.68 18.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.078 -175.127 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -53.64 -44.77 69.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.242 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.11 -51.89 67.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.59 -43.43 96.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.484 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.2 mt -53.93 -47.41 71.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.896 0.379 . . . . 0.0 111.231 178.586 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -72.53 -29.25 63.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.483 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.9 m -69.33 -41.22 76.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.871 176.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.717 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 37.9 m0 -60.08 -46.09 90.73 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 174.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -57.82 -48.74 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.593 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -56.84 -53.27 59.78 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.563 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -65.72 -30.36 71.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.442 -177.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.0 -38.79 89.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.909 0.385 . . . . 0.0 110.294 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.3 -30.9 38.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.161 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.41 ' O ' ' HD3' ' A' ' 57' ' ' PRO . 45.4 tttt -79.46 -15.5 57.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.682 -178.567 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -108.65 92.02 9.61 Favored Pre-proline 0 C--N 1.315 -0.933 0 N-CA-C 108.525 -0.916 . . . . 0.0 108.525 173.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.41 ' HD3' ' O ' ' A' ' 55' ' ' LYS . 31.3 Cg_exo -59.03 123.17 12.9 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.941 2.427 . . . . 0.0 113.018 -172.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.51 143.81 83.02 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.569 2.179 . . . . 0.0 110.812 174.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -99.19 148.18 24.36 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -174.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 C--N 1.323 -0.546 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.079 177.248 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.3 mp -97.51 112.7 30.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.206 0.527 . . . . 0.0 110.446 -178.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.5 HD11 HD13 ' A' ' 46' ' ' LEU . 2.4 mm? -65.71 -33.35 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.035 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -52.37 -54.18 35.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.907 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.91 -44.67 96.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.337 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.68 -51.41 69.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.421 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.56 -41.62 92.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.607 0.241 . . . . 0.0 110.745 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.59 -13.95 62.59 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.584 -179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -82.19 -40.24 22.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -76.99 -51.75 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.741 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -118.14 98.17 51.26 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.137 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.15 -31.33 54.54 Favored 'Trans proline' 0 CA--C 1.528 0.211 0 C-N-CA 123.032 2.488 . . . . 0.0 113.123 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -102.61 19.49 18.97 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -176.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.88 119.53 24.52 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.52 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.423 ' C ' ' H ' ' A' ' 17' ' ' ARG . 47.5 t -84.7 88.55 2.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.548 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.486 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 9.9 p -85.89 36.73 0.68 Allowed 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.459 1.123 . . . . 0.0 110.24 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 15' ' ' VAL . 93.8 mtt180 -97.29 -60.34 1.6 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 113.629 -1.623 . . . . 0.0 110.988 175.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.5 tttp -128.89 -43.09 1.37 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 111.655 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.611 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 5.6 t70 -65.26 -34.74 79.07 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.486 ' CE2' ' HB3' ' A' ' 16' ' ' SER . 14.1 p90 -143.44 132.08 22.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 164.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -105.13 141.72 36.18 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.744 -169.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.5 mt -113.49 152.71 29.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.687 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -144.91 174.57 10.9 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.126 0.488 . . . . 0.0 109.828 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -129.99 117.53 20.21 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.763 -176.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.92 -27.18 57.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.297 0.57 . . . . 0.0 109.703 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.54 -42.37 1.17 Allowed Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.637 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -99.47 -0.07 41.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.443 0.639 . . . . 0.0 110.644 -176.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 177.22 155.99 14.97 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.226 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.8 m -105.05 122.16 45.29 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -130.84 -179.3 5.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.983 -173.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.3 mt -87.36 132.81 31.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.585 ' HG3' ' HD2' ' A' ' 33' ' ' LYS . 13.1 pt-20 -111.63 -34.01 6.19 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.24 176.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HD2' ' HG3' ' A' ' 32' ' ' GLU . 10.1 mptt -126.02 148.71 49.23 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 175.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -144.04 111.61 6.03 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 90.1 m-20 -123.06 13.66 9.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.704 0.288 . . . . 0.0 110.643 -178.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.416 HD23 ' OD2' ' A' ' 19' ' ' ASP . 48.0 mt -66.22 153.45 42.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.183 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 37' ' ' ARG . 62.2 mtt180 -82.13 42.35 0.73 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.127 178.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -152.4 154.58 32.16 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.484 -177.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.94 171.1 17.31 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.327 2.018 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -79.51 135.63 56.7 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.794 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.63 173.51 12.45 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.724 2.282 . . . . 0.0 111.819 176.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.617 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 34.2 p -99.11 161.4 13.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.073 -177.306 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.66 -44.76 85.93 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.07 -45.86 89.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.363 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.51 -45.01 95.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.656 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.6 mt -50.89 -50.47 57.13 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.494 0.496 . . . . 0.0 111.476 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -71.28 -28.62 64.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -178.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.9 m -66.03 -38.9 89.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.88 0.371 . . . . 0.0 110.31 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -63.17 -42.98 99.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -61.89 -44.73 96.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.373 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -61.09 -46.98 88.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.427 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -66.98 -28.7 68.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.281 . . . . 0.0 111.372 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.86 -54.8 21.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.842 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.99 -32.41 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.555 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -95.85 27.61 3.46 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -41.32 146.51 0.52 Allowed Pre-proline 0 N--CA 1.469 0.525 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.425 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.07 163.96 32.16 Favored 'Trans proline' 0 C--O 1.236 0.412 0 C-N-CA 122.748 2.299 . . . . 0.0 111.563 175.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.9 157.49 61.54 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.397 2.065 . . . . 0.0 112.073 176.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -125.95 124.13 40.09 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.17 -179.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.272 179.872 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.5 mmm . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.649 0.261 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.7 mm -87.53 110.76 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 2.3 mm? -69.22 -38.06 78.35 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.488 -175.653 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.407 ' CD1' HD11 ' A' ' 22' ' ' LEU . 27.7 t80 -54.73 -48.69 72.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.525 -176.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.4 -49.88 76.12 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.213 0.321 . . . . 0.0 111.016 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.407 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -59.88 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.587 -178.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.45 -43.55 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -23.13 66.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.855 -177.13 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -77.09 -48.61 17.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.194 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.93 -27.72 23.18 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.73 0.3 . . . . 0.0 110.649 -177.118 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -116.16 83.62 12.83 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -67.15 -28.46 40.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.904 2.403 . . . . 0.0 113.211 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -111.26 27.14 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.659 -174.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.65 141.91 34.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.64 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.522 ' HB ' ' HB2' ' A' ' 19' ' ' ASP . 41.6 t -81.02 103.72 8.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.063 0.458 . . . . 0.0 111.144 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.0 m -69.82 140.29 53.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.234 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.1 mtt-85 71.12 11.96 6.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.556 173.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -140.4 -59.66 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.796 0.331 . . . . 0.0 110.452 173.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.522 ' HB2' ' HB ' ' A' ' 15' ' ' VAL . 0.5 OUTLIER -76.39 -26.31 55.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.265 0.555 . . . . 0.0 110.024 176.955 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -142.25 114.4 8.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 166.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -94.14 136.12 34.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.582 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.407 HD11 ' CD1' ' A' ' 4' ' ' TYR . 23.3 mt -105.86 152.79 22.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.626 -175.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.848 HH11 ' HG2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -139.74 155.51 47.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.366 174.236 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -88.35 109.6 20.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.882 -178.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.543 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 28.1 t70 -84.82 -42.84 14.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.08 0.467 . . . . 0.0 111.205 -178.105 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.37 -39.09 0.93 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.675 -177.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -107.19 27.84 8.65 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.62 179.52 15.81 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.124 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 4.0 m -90.99 131.31 36.67 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.57 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 1.7 p90 -125.94 -177.95 4.12 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.0 mt -74.67 121.54 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.091 0.472 . . . . 0.0 111.449 -175.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.848 ' HG2' HH11 ' A' ' 23' ' ' ARG . 3.7 tp10 -100.22 -52.66 3.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 176.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -129.56 111.36 12.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.557 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -100.89 112.41 24.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 -177.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.466 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 80.6 m-20 -114.63 -6.12 12.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.621 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.462 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 36.5 mt -65.54 137.73 57.59 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.482 0.658 . . . . 0.0 111.278 -178.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -83.27 36.18 0.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.926 0.87 . . . . 0.0 109.901 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.409 ' H ' ' C ' ' A' ' 36' ' ' LEU . . . -125.08 147.48 57.15 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.458 -1.247 . . . . 0.0 109.751 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.08 144.61 94.6 Favored 'Trans proline' 0 C--O 1.238 0.525 0 C-N-CA 123.023 2.482 . . . . 0.0 113.011 178.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.403 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 4.3 mm? -66.31 126.86 92.79 Favored Pre-proline 0 N--CA 1.45 -0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.33 176.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.411 ' HB3' ' CH2' ' A' ' 49' ' ' TRP . 12.3 Cg_endo -57.69 150.83 59.29 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.019 2.479 . . . . 0.0 112.564 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 p -102.72 168.6 9.14 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.896 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -56.59 -54.57 44.48 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.938 -178.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.98 85.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.027 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.579 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 34.0 mt-10 -57.44 -54.34 47.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.982 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.5 mt -51.68 -49.39 62.48 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.585 -178.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.19 -31.86 68.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.649 -177.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.2 m -67.36 -44.33 79.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.901 178.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.579 ' CZ2' ' HB3' ' A' ' 45' ' ' GLU . 15.5 m0 -64.18 -39.49 94.12 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.585 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -60.31 -49.14 78.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.173 176.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -62.36 -43.89 97.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.717 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.98 -36.55 83.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.239 -0.184 . . . . 0.0 110.742 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -64.18 -39.91 94.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.806 0.336 . . . . 0.0 110.504 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.585 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 26.9 mm-40 -66.9 -37.18 83.89 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.424 0.631 . . . . 0.0 109.963 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -86.97 5.63 36.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.043 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -99.93 138.86 20.42 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.19 -176.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -61.6 133.42 45.44 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.917 2.411 . . . . 0.0 111.805 174.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -53.01 141.2 57.71 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.976 2.451 . . . . 0.0 113.224 -176.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -80.12 124.66 28.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.48 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 . . . . . 0 C--N 1.327 -0.391 0 O-C-N 123.427 0.454 . . . . 0.0 110.324 178.866 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.6 0.238 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 59.2 mt -119.39 128.76 75.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.482 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.8 mm? -67.19 -37.58 83.92 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.248 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -52.44 -46.61 66.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.471 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.65 -47.31 85.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.828 0.347 . . . . 0.0 111.12 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.4 95.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.397 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.7 mt -63.37 -40.74 90.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.63 179.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.9 mmt -68.46 -21.93 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.74 0.305 . . . . 0.0 111.313 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -74.67 -43.44 55.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 0.0 110.541 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -90.81 -35.33 14.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.687 -175.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -121.6 84.55 42.81 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.542 0.21 . . . . 0.0 111.253 -176.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -70.9 -22.9 26.25 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.895 2.397 . . . . 0.0 112.782 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -95.94 8.36 43.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.452 -176.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.99 139.89 31.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.2 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 t -106.16 127.6 61.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 CA-C-O 121.118 0.485 . . . . 0.0 111.108 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.7 p -73.09 152.67 41.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.034 176.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.1 mtm180 65.25 17.04 10.86 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.208 0.527 . . . . 0.0 109.96 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -141.58 -73.73 0.32 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.468 -174.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.406 ' HB3' HD21 ' A' ' 36' ' ' LEU . 53.9 m-20 -80.34 -29.71 38.0 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.453 0.644 . . . . 0.0 109.857 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -139.93 136.18 33.58 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.918 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.712 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 5.8 tp10 -96.61 127.24 42.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.273 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.7 mt -100.69 153.46 19.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.977 0.417 . . . . 0.0 110.126 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -129.71 142.2 50.75 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -94.73 109.99 21.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.114 0.483 . . . . 0.0 110.878 -176.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -79.02 -39.2 34.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.399 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.19 -42.22 1.64 Allowed Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -173.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -89.13 -5.89 57.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.856 0.836 . . . . 0.0 109.024 173.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 167.93 -177.89 41.98 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.44 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 21.3 m -120.34 130.59 54.49 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.4 p90 -124.4 -179.77 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.248 0.343 . . . . 0.0 111.231 -176.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.7 mt -84.85 121.41 36.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.365 0.602 . . . . 0.0 111.466 -173.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -96.9 -58.29 2.07 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.296 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.712 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 9.7 ttmm -113.58 138.67 49.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.206 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -125.83 112.16 15.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -116.31 11.03 14.93 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.901 0.381 . . . . 0.0 111.41 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 19' ' ' ASP . 66.6 mt -87.69 144.29 26.73 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.901 0.382 . . . . 0.0 111.124 -178.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -81.5 62.88 5.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.43 0.633 . . . . 0.0 109.811 174.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.22 143.65 19.69 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.577 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.31 146.89 93.34 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.578 2.185 . . . . 0.0 111.817 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.82 118.91 62.46 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.342 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.18 146.02 97.22 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.692 2.262 . . . . 0.0 112.548 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 9.2 p -93.82 171.75 8.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.738 -177.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.559 HE21 ' HG3' ' A' ' 47' ' ' GLU . 21.6 tp60 -53.78 -51.69 62.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.694 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.08 -42.56 76.89 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.276 178.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -50.02 72.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.957 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.9 mt -58.05 -44.48 87.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.682 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.559 ' HG3' HE21 ' A' ' 43' ' ' GLN . 42.6 mt-10 -65.13 -44.06 89.88 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.103 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -59.06 -43.67 91.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -61.28 -40.74 95.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.355 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.0 t-105 -66.29 -44.08 84.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.123 177.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 64.5 mt-10 -61.28 -42.4 98.59 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.887 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.34 -30.81 62.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.767 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.4 tp -77.57 -40.01 43.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.01 0.433 . . . . 0.0 111.025 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -83.47 -23.22 32.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -86.99 -16.02 36.98 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.361 0.6 . . . . 0.0 110.385 176.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 . . . . . 0 C--N 1.316 -0.875 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.309 -179.672 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.436 ' SD ' ' HG2' ' A' ' 47' ' ' GLU . 18.0 ptt? . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.054 0.454 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.67 125.76 73.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.549 HD11 HD13 ' A' ' 46' ' ' LEU . 4.0 mm? -61.04 -40.29 93.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.7 -176.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.574 ' HB2' HD11 ' A' ' 22' ' ' LEU . 15.1 t80 -55.2 -51.68 65.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.222 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -60.76 -46.86 88.83 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.369 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.85 84.15 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.337 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.5 HD11 HD11 ' A' ' 31' ' ' ILE . 70.3 mt -67.27 -45.55 85.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 -179.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.2 mmt -65.96 -27.83 68.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.618 -176.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -75.95 -42.21 49.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.028 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.56 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 9.4 tmtt? -84.49 -36.57 22.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.827 -176.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.56 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 92.4 m-85 -127.62 88.23 54.08 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.008 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.84 -20.53 17.16 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.684 2.256 . . . . 0.0 112.266 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -86.24 5.59 33.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.892 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.65 129.67 37.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.2 t -90.37 110.28 21.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.35 0.595 . . . . 0.0 111.405 -175.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 20' ' ' PHE . 22.1 p -79.85 162.06 25.26 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 63.57 23.04 13.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.595 0.712 . . . . 0.0 110.116 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -145.89 -68.21 0.28 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.788 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.586 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 27.2 m-20 -88.93 -52.78 4.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.392 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.662 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 41.3 p90 -117.62 130.2 56.23 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.315 0.578 . . . . 0.0 111.411 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.767 ' HB2' ' HB2' ' A' ' 33' ' ' LYS . 2.0 mp0 -129.6 161.69 29.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.228 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 4' ' ' TYR . 46.5 mt -96.57 154.38 17.31 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.621 0.724 . . . . 0.0 111.971 -173.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.613 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 1.8 tpt180 -134.24 156.37 48.52 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -89.89 120.68 31.32 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.515 -0.474 . . . . 0.0 111.115 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.611 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 23.3 t70 -92.27 -23.93 19.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.923 177.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.8 -47.97 0.99 Allowed Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.201 -175.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.585 0.707 . . . . 0.0 109.869 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 169.43 -179.87 41.71 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.596 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 m -98.29 119.27 36.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.611 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 24.6 p90 -110.04 -179.44 3.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.842 0.353 . . . . 0.0 111.034 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.5 HD11 HD11 ' A' ' 7' ' ' ILE . 35.3 mt -91.03 123.01 43.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.797 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.613 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 2.1 tm-20 -119.93 -52.99 2.19 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.767 ' HB2' ' HB2' ' A' ' 21' ' ' GLU . 2.7 mmmp? -78.6 113.67 16.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.634 173.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -134.76 110.34 9.15 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.586 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 2.1 m-20 -118.91 4.17 11.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.196 -178.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.3 mt -73.78 141.23 46.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.072 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -79.96 46.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.341 0.591 . . . . 0.0 110.803 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.48 145.82 30.28 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.881 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.24 155.21 51.72 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.653 2.235 . . . . 0.0 112.441 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.0 mm? -71.66 137.08 83.02 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.161 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.529 ' HG2' HD21 ' A' ' 46' ' ' LEU . 74.4 Cg_endo -76.25 -177.91 4.03 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.078 2.518 . . . . 0.0 112.098 175.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.457 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 40.5 p -98.64 164.82 12.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.935 -177.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.423 ' HA ' HD12 ' A' ' 46' ' ' LEU . 5.8 tt0 -60.44 -46.03 91.51 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 110.038 -178.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.43 -48.09 74.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -56.95 -51.22 70.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.257 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.549 HD13 HD11 ' A' ' 3' ' ' LEU . 68.2 mt -54.88 -50.82 67.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.438 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 48.2 mt-10 -66.75 -33.35 75.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.509 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.9 m -65.87 -37.9 87.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.539 0.209 . . . . 0.0 110.705 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.472 ' CE2' ' HG3' ' A' ' 10' ' ' LYS . 22.1 m0 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.715 0.293 . . . . 0.0 110.244 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -60.92 -44.55 97.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.205 0.526 . . . . 0.0 110.03 173.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.9 mt-10 -61.38 -46.66 89.28 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.14 177.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 51.7 mt-10 -63.33 -42.28 98.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.855 178.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.1 tp -57.87 -43.94 86.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.916 0.389 . . . . 0.0 111.191 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -75.56 -33.12 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.908 -174.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 48.0 tttm -84.59 -7.48 59.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.04 0.448 . . . . 0.0 111.577 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 5.0 t30 . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.768 -174.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.483 1.218 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.439 ' H ' HD12 ' A' ' 2' ' ' ILE . 4.3 mp -78.87 104.42 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.484 0.659 . . . . 0.0 110.434 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -71.12 -31.92 68.36 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.265 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -51.04 -53.89 29.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.378 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.417 ' HB3' HD21 ' A' ' 53' ' ' LEU . 1.8 m-20 -64.52 -42.4 95.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.472 -178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB1' ' HB3' ' A' ' 49' ' ' TRP . . . -59.87 -44.22 94.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.724 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 3' ' ' LEU . 83.5 mt -61.84 -42.17 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.579 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.4 mmt -66.34 -22.88 66.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.957 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -71.93 -45.99 59.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -87.75 -42.45 12.6 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.282 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -117.84 86.96 25.93 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 116.66 -0.245 . . . . 0.0 110.788 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.64 -26.84 22.99 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.742 2.295 . . . . 0.0 112.825 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -91.33 12.13 21.44 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.83 132.71 40.81 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 176.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.0 t -101.56 127.15 55.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.9 m -67.22 141.85 57.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.044 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ttm-85 61.79 22.77 13.26 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.917 0.887 . . . . 0.0 111.225 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -135.0 -62.21 0.73 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.264 172.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.461 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 47.0 m-20 -89.93 -27.68 19.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.051 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -152.06 144.36 24.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.807 177.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 39.8 tt0 -126.6 136.17 52.19 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 mt -89.83 154.08 20.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.939 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 32' ' ' GLU . 9.3 tpp180 -136.45 153.35 51.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.582 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -87.07 112.39 21.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.895 0.378 . . . . 0.0 110.354 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.538 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 19.4 t70 -82.51 -21.07 35.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.488 0.661 . . . . 0.0 110.262 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.12 -41.06 2.34 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -170.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -78.59 -6.46 55.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.062 -0.569 . . . . 0.0 110.444 173.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 143.07 -171.79 24.82 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.132 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.549 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.0 m -95.73 111.25 23.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.538 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -123.9 -176.39 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.905 -177.068 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.8 mt -81.12 131.56 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.863 0.363 . . . . 0.0 111.158 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 23' ' ' ARG . 12.8 tt0 -125.63 -58.95 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.572 173.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 7.5 tmtm? -87.65 125.97 34.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.389 -175.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -134.9 115.74 13.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.653 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -112.59 1.2 15.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.747 -176.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.461 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 77.7 mt -90.77 154.75 19.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -175.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -85.94 43.21 1.03 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -119.84 143.07 34.34 Favored Pre-proline 0 C--N 1.315 -0.897 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.226 -175.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.48 142.49 72.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.485 2.123 . . . . 0.0 112.283 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -76.35 125.31 87.81 Favored Pre-proline 0 N--CA 1.447 -0.609 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.532 ' HG3' ' CH2' ' A' ' 49' ' ' TRP . 33.9 Cg_endo -63.92 158.56 46.59 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 123.143 2.562 . . . . 0.0 112.386 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.432 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 60.5 p -81.62 169.73 16.69 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.454 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -60.34 -43.77 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.65 71.48 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -61.38 -45.25 95.16 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.768 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.493 HD22 HD11 ' A' ' 3' ' ' LEU . 88.1 mt -52.79 -48.8 66.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.594 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.21 -30.36 68.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.776 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.4 m -66.54 -38.14 86.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.417 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.532 ' CH2' ' HG3' ' A' ' 41' ' ' PRO . 46.4 m0 -56.42 -51.39 68.57 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.059 0.457 . . . . 0.0 109.855 175.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -59.21 -46.63 87.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.609 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.02 -46.45 90.7 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.673 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.34 -39.22 93.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.914 0.388 . . . . 0.0 110.815 178.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 5' ' ' ASP . 52.0 tp -64.79 -44.09 91.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.16 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -73.94 -32.8 63.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.0 -177.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.6 tttm -90.29 -3.37 57.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.729 0.3 . . . . 0.0 111.787 -173.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.817 -179.018 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.855 0.359 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.65 120.39 64.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.56 -0.534 . . . . 0.0 109.56 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.531 HD11 HD22 ' A' ' 46' ' ' LEU . 2.4 mm? -70.38 -34.02 72.09 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.1 -47.43 65.26 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.416 0.447 . . . . 0.0 110.925 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.415 ' HB2' ' HZ3' ' A' ' 50' ' ' TRP . 4.5 m-20 -67.81 -48.06 67.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.155 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.15 78.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.737 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 84.2 mt -62.38 -45.53 98.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.73 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.1 ttm -73.98 -24.41 59.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.294 -175.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -65.45 -43.0 91.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 174.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -79.38 -44.3 21.77 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.571 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -122.6 92.85 48.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.354 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.18 -24.24 38.44 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.905 2.404 . . . . 0.0 112.637 -177.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -94.27 10.1 35.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.603 0.716 . . . . 0.0 110.359 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.431 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -80.51 95.36 6.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.455 174.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.2 t -77.92 110.31 13.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.48 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 18.3 m -64.99 153.55 40.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.988 176.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 17' ' ' ARG . 58.8 mtt180 75.33 -33.9 0.24 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.558 0.743 . . . . 0.0 111.004 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 16' ' ' SER . 42.4 tptt -80.02 -59.99 2.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.133 0.492 . . . . 0.0 110.255 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.603 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 11.7 t70 -100.25 -48.03 4.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.205 -176.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.431 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 29.8 p90 -131.08 143.83 50.97 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.198 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.433 ' H ' ' HB3' ' A' ' 33' ' ' LYS . 45.5 tt0 -129.86 132.99 46.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.44 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 36.2 mt -99.91 154.23 18.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.082 0.468 . . . . 0.0 111.38 -173.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.483 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -124.16 162.68 23.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.455 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -101.82 106.73 17.75 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.34 -40.95 22.77 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.3 -173.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.4 -58.6 0.16 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.539 -0.838 . . . . 0.0 112.417 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -94.2 -5.99 45.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.88 0.371 . . . . 0.0 111.225 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 176.53 179.56 47.02 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.048 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 10.4 p -105.7 132.45 51.82 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.452 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 52.6 p90 -146.13 -173.59 4.21 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.905 0.384 . . . . 0.0 111.458 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.44 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 23.6 mt -62.15 127.48 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.411 -170.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.483 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 10.2 tp10 -118.66 -58.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 172.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.26 126.95 43.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.12 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -139.7 111.58 7.39 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.95 -11.21 15.37 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.57 -0.452 . . . . 0.0 112.15 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.603 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 60.0 mt -55.3 133.36 49.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.149 0.5 . . . . 0.0 110.896 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 37' ' ' ARG . 54.9 mtt180 -80.12 61.05 3.84 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.532 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.38 141.4 16.32 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.497 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.01 137.16 75.73 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 123.068 2.512 . . . . 0.0 112.204 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.436 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 4.4 mm? -57.74 122.58 57.74 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.231 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 40' ' ' LEU . 18.5 Cg_endo -60.13 158.77 28.78 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.995 2.463 . . . . 0.0 112.234 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.587 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 27.5 p -99.81 162.69 12.84 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -51.79 -49.53 62.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.567 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.43 -46.82 83.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.028 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.97 -44.6 94.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.255 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 42' ' ' THR . 82.7 mt -58.47 -46.16 87.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.476 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.81 -34.85 76.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.755 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.415 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 58.8 m -62.57 -42.93 99.85 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.852 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.401 ' CH2' ' HB3' ' A' ' 41' ' ' PRO . 41.0 m0 -65.8 -37.11 85.38 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.952 0.406 . . . . 0.0 110.323 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.415 ' HZ3' ' HB2' ' A' ' 5' ' ' ASP . 68.6 t-105 -62.65 -45.51 92.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.005 174.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.54 -36.84 85.0 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.691 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 48' ' ' THR . 43.3 mt-10 -59.6 -46.53 88.69 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.126 174.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.13 -47.3 85.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.949 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -64.82 -28.31 69.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.227 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -95.56 2.51 54.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.99 0.424 . . . . 0.0 110.798 -178.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 . . . . . 0 C--N 1.322 -0.615 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.169 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.863 0.363 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.69 HG23 ' HB2' ' A' ' 29' ' ' SER . 2.9 mp -90.86 122.79 42.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.014 0.435 . . . . 0.0 110.253 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.438 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.2 mm? -61.83 -30.87 71.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.129 -176.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -51.23 -45.73 62.03 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.173 -177.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -63.45 -49.58 73.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.987 0.423 . . . . 0.0 111.191 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.405 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -59.98 -46.25 90.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.515 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -63.34 -41.77 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.15 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.436 ' HA ' ' CE ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -64.37 -29.0 70.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.944 -178.207 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -76.02 -38.17 57.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.804 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.476 ' HD3' ' CE2' ' A' ' 49' ' ' TRP . 42.8 tptt -76.17 -45.46 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.81 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -126.47 83.94 63.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.218 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.58 -21.39 46.02 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.735 2.29 . . . . 0.0 112.091 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.14 4.72 47.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.638 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -98.9 138.24 36.3 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -96.83 121.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-O 120.981 0.42 . . . . 0.0 111.018 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 138.62 58.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.689 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 69.0 13.73 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.615 0.572 . . . . 0.0 111.316 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HG3' ' OD1' ' A' ' 19' ' ' ASP . 24.2 tptp -116.26 -72.82 0.67 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.405 177.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.495 ' OD1' ' HG3' ' A' ' 18' ' ' LYS . 3.0 m-20 -101.77 -1.05 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.301 0.572 . . . . 0.0 110.924 -179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -148.2 124.03 10.59 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 169.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.896 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 34.2 tt0 -110.65 126.57 54.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.126 -176.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.569 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 29.8 mt -103.75 152.86 21.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.996 -173.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.569 ' HD2' ' O ' ' A' ' 22' ' ' LEU . 2.3 mpt_? -133.94 174.59 10.31 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.502 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -89.46 122.17 32.4 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.178 178.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.27 -38.77 26.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.356 0.598 . . . . 0.0 110.206 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.49 -56.99 0.47 Allowed Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.866 -176.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -97.8 -11.0 23.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.557 0.694 . . . . 0.0 109.903 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -168.23 -166.53 27.45 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.71 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.69 ' HB2' HG23 ' A' ' 2' ' ' ILE . 42.3 m -102.39 141.83 34.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.647 0.224 . . . . 0.0 110.514 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.54 177.99 7.39 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 45.1 mt -84.66 131.43 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.624 -177.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.46 -55.24 2.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.164 0.507 . . . . 0.0 109.812 174.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.896 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 4.8 ttmp? -109.91 110.18 21.05 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.382 -176.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -105.33 112.81 26.06 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -118.06 6.06 12.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.184 0.516 . . . . 0.0 110.565 -174.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 57.4 mt -81.28 149.23 29.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.9 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -83.13 40.08 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.362 0.601 . . . . 0.0 110.7 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -128.7 152.78 79.3 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.642 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.33 156.06 67.02 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.317 2.012 . . . . 0.0 111.994 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -71.91 125.32 91.61 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.417 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 23.8 Cg_endo -61.71 159.38 33.07 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.99 2.46 . . . . 0.0 112.599 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.598 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 61.7 p -94.64 156.14 16.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.28 -178.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.0 tm0? -52.41 -45.27 65.82 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.71 0.631 . . . . 0.0 109.832 177.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.2 -51.77 68.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.608 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.7 -34.71 78.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.132 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.4 mt -54.34 -46.54 72.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.88 -26.65 59.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.2 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.8 m -63.89 -46.99 82.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.264 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.476 ' CE2' ' HD3' ' A' ' 10' ' ' LYS . 13.6 m0 -63.78 -35.45 80.65 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.08 0.467 . . . . 0.0 109.782 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -60.96 -49.22 78.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.595 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -64.11 -38.83 92.47 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.666 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.66 -48.82 77.67 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.914 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.9 tp -60.54 -22.22 63.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.128 0.49 . . . . 0.0 110.833 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.78 -46.14 10.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.231 178.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.84 -17.08 42.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 54.2 t30 . . . . . 0 C--N 1.311 -1.098 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.844 -173.472 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 ppp? . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.5 mp -112.88 128.77 69.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.13 -179.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.7 mm? -67.59 -40.52 84.79 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.791 0.329 . . . . 0.0 111.376 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.523 ' CD1' HD11 ' A' ' 22' ' ' LEU . 40.4 t80 -52.62 -47.29 67.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.995 -176.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.53 -44.61 93.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.534 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.519 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -64.58 -45.82 85.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.787 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.6 mt -58.86 -48.26 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.69 178.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -26.38 68.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.846 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -69.2 -49.69 54.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.321 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.654 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 86.1 tttt -77.8 -35.76 51.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.996 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -117.8 79.84 13.6 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.852 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.445 ' HD3' ' O ' ' A' ' 10' ' ' LYS . 3.4 Cg_exo -78.38 -23.3 8.81 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.964 2.443 . . . . 0.0 112.066 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -85.19 -6.48 59.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.76 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.4 127.93 34.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.521 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.8 t -82.7 121.13 35.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.093 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.3 t -69.0 143.25 54.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.191 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HA ' ' HG2' ' A' ' 21' ' ' GLU . 81.5 mtt180 63.14 21.43 12.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.964 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -109.29 -69.64 0.85 Allowed 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.418 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -99.43 -46.21 5.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.468 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 32.8 p90 -100.68 138.16 38.12 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 175.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.463 ' CB ' ' HB3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -131.1 142.53 50.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.041 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.523 HD11 ' CD1' ' A' ' 4' ' ' TYR . 14.0 mt -101.71 144.81 29.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.842 -172.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -143.43 169.37 17.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.552 176.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 29' ' ' SER . 10.6 t30 -106.09 112.28 25.26 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.609 -176.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.591 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 30.8 t70 -79.64 -28.37 40.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.803 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 175.84 -95.44 0.1 Allowed Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.484 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -95.91 35.29 1.42 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.483 0.658 . . . . 0.0 109.789 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.77 148.9 7.12 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.97 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 24' ' ' ASN . 16.9 m -99.17 129.05 45.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.591 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -134.78 -168.68 2.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.946 0.403 . . . . 0.0 110.971 -173.114 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -81.96 132.69 30.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.174 177.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -125.23 -53.67 1.61 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 20' ' ' PHE . 58.2 tttm -94.55 122.91 37.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.875 178.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -136.47 111.01 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -118.15 3.71 12.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.249 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.7 mt -71.86 137.62 47.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -79.81 59.58 3.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.87 0.843 . . . . 0.0 110.238 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -139.76 150.58 63.4 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.136 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.57 147.85 46.59 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.187 1.925 . . . . 0.0 111.898 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.11 130.87 93.19 Favored Pre-proline 0 N--CA 1.449 -0.49 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.03 176.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.468 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 41.8 Cg_endo -68.19 168.61 18.75 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.848 2.365 . . . . 0.0 112.994 -177.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 41.1 p -104.33 165.29 11.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.546 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -57.36 -43.77 83.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.291 0.567 . . . . 0.0 109.735 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.79 -47.82 73.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.97 -1.014 . . . . 0.0 110.633 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.434 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 30.4 mt-10 -58.24 -53.42 58.48 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 176.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.8 mt -52.31 -49.09 64.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.627 -177.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.72 -33.45 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.627 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 91.8 m -64.08 -45.28 89.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.554 0.216 . . . . 0.0 110.556 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.654 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.0 m0 -63.72 -42.13 97.98 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -63.1 -44.31 96.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.801 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -62.29 -46.73 87.44 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.497 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.547 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 45.5 mt-10 -64.0 -37.35 87.1 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.861 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.9 tp -65.09 -30.03 70.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.869 0.366 . . . . 0.0 110.914 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -91.39 -39.76 11.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.091 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -88.4 -15.8 34.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.162 0.506 . . . . 0.0 111.447 -173.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.547 ' HB3' ' O ' ' A' ' 52' ' ' GLU . 9.0 t30 . . . . . 0 C--N 1.315 -0.929 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.533 176.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 ttt . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.471 ' N ' HD12 ' A' ' 2' ' ' ILE . 3.9 mp -87.13 112.62 23.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.457 HD11 HD13 ' A' ' 46' ' ' LEU . 2.9 mm? -70.13 -34.36 72.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.113 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -51.17 -49.18 61.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.861 -175.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.25 -51.09 70.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.339 -177.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.72 90.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.461 -177.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 3' ' ' LEU . 77.8 mt -63.25 -47.86 90.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.249 -178.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.4 ttm -76.25 -16.99 59.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.969 0.414 . . . . 0.0 111.012 -174.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.438 ' CD2' ' HB3' ' A' ' 49' ' ' TRP . 92.4 t80 -69.38 -44.72 70.9 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 174.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -82.07 -37.21 26.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.092 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -124.17 97.74 39.91 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 121.069 0.462 . . . . 0.0 111.226 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -66.53 -27.81 45.93 Favored 'Trans proline' 0 CA--C 1.528 0.185 0 C-N-CA 122.857 2.371 . . . . 0.0 112.567 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -87.34 8.82 22.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.667 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.528 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -78.71 107.06 11.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.895 0.379 . . . . 0.0 110.526 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.67 105.83 15.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.406 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m -70.03 140.97 52.94 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.441 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 71.38 12.4 6.65 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.577 177.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -116.38 -76.48 0.57 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -91.5 -31.24 16.03 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.147 0.499 . . . . 0.0 110.415 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.528 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 17.2 p90 -127.62 135.67 50.58 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 170.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -130.51 139.96 50.5 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.464 0.649 . . . . 0.0 110.557 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.0 mt -93.61 146.86 23.51 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.493 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.428 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.9 mpt_? -130.92 169.8 15.31 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 176.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -92.3 117.86 30.32 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.441 -175.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -86.82 -26.24 24.16 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 132.18 -38.31 1.91 Allowed Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.03 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -87.44 -22.34 25.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.355 0.598 . . . . 0.0 110.427 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 171.02 -160.24 32.58 Favored Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.351 177.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 m -99.24 112.3 24.49 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -116.9 173.63 6.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.442 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.6 mt -69.96 114.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.248 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.428 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 1.6 tm-20 -121.1 -53.62 2.04 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.678 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.82 116.91 32.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -129.36 111.86 13.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -114.55 3.88 15.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.921 0.391 . . . . 0.0 110.813 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.8 mt -70.66 145.58 50.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.89 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -81.79 49.03 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.144 0.497 . . . . 0.0 110.396 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . . . -146.17 140.05 15.11 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.808 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 38' ' ' ALA . 38.6 Cg_exo -61.92 148.25 93.52 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.075 2.517 . . . . 0.0 112.59 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.08 142.95 90.82 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.296 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.19 171.72 16.27 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.387 2.058 . . . . 0.0 110.963 170.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.7 p -104.6 167.77 9.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.49 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -56.61 -47.95 78.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.136 0.493 . . . . 0.0 110.021 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.11 -48.88 73.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.172 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -57.39 -49.73 75.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.303 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.457 HD13 HD11 ' A' ' 3' ' ' LEU . 91.7 mt -55.59 -47.74 76.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.046 0.45 . . . . 0.0 111.184 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -75.9 -18.0 59.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.635 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.3 m -64.92 -50.08 67.88 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.438 ' HB3' ' CD2' ' A' ' 9' ' ' TYR . 8.1 m0 -67.26 -31.74 72.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.22 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -62.09 -44.77 95.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.927 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -60.8 -46.19 91.49 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.842 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.39 -35.8 81.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.915 0.388 . . . . 0.0 111.0 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.3 tp -65.42 -38.84 91.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.667 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.71 -25.37 41.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.127 0.489 . . . . 0.0 110.435 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.444 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 43.2 tttm -87.16 18.92 3.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.244 178.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 55' ' ' LYS . 11.5 t30 . . . . . 0 N--CA 1.467 0.386 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.408 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.4 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.421 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.4 mp -104.87 115.31 46.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.512 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.2 OUTLIER -63.44 -32.76 74.29 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.096 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.402 ' HE1' ' HB3' ' A' ' 16' ' ' SER . 22.8 t80 -52.98 -48.57 67.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.084 -176.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.6 -48.8 79.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.351 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.69 -43.78 85.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.432 178.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -67.09 -38.31 80.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.54 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.0 mmt -68.64 -22.5 64.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.481 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -79.25 -38.31 35.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.848 0.356 . . . . 0.0 110.309 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? -80.68 -50.78 9.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.96 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -118.81 85.33 27.79 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.992 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.64 -20.85 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.624 2.216 . . . . 0.0 112.879 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -90.1 -8.34 51.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.073 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.14 141.93 58.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.327 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.448 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 33.4 t -104.12 128.44 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.14 0.495 . . . . 0.0 110.738 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.402 ' HB3' ' HE1' ' A' ' 4' ' ' TYR . 3.0 p -70.67 141.81 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.321 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 43.2 mtt180 65.55 25.12 11.77 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.513 0.673 . . . . 0.0 110.705 -176.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 84.8 tttt -140.92 -60.16 0.5 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.382 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.401 ' HB3' HD21 ' A' ' 36' ' ' LEU . 33.8 m-20 -86.98 -38.36 16.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.865 176.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 p90 -152.26 149.37 28.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.043 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 66.7 tt0 -136.02 135.39 39.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.466 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 48.9 mt -117.24 155.19 29.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.863 0.363 . . . . 0.0 111.627 -170.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 29' ' ' SER . 5.6 mpt_? -124.22 173.73 8.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.017 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -98.43 119.55 37.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.655 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -81.1 -33.08 33.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.226 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.96 -36.25 3.51 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -170.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -95.33 9.41 39.97 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 173.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 134.27 -176.7 19.68 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.789 -178.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.454 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 11.1 m -84.67 130.57 34.69 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -120.42 171.43 8.54 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 110.606 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.512 HG13 ' HG ' ' A' ' 3' ' ' LEU . 62.7 mt -82.33 121.77 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.23 -176.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -108.75 -58.41 2.01 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 176.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 32.0 mmtp -99.17 131.74 44.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.516 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -133.58 111.62 10.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 175.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -114.18 1.29 14.5 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.081 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.401 HD21 ' HB3' ' A' ' 19' ' ' ASP . 76.8 mt -78.73 147.71 33.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 -177.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.7 mtp180 -87.5 36.06 0.74 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.432 177.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.23 141.1 38.81 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.006 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.79 148.73 93.05 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.826 2.35 . . . . 0.0 112.459 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.91 128.59 93.37 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.661 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.43 ' HG2' HD21 ' A' ' 46' ' ' LEU . 56.1 Cg_endo -71.23 171.67 15.57 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.546 2.164 . . . . 0.0 111.909 176.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.475 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.9 p -93.6 165.29 12.8 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.702 -177.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -59.22 -39.66 83.37 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.168 178.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.92 95.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.314 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.55 -48.48 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.879 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 42' ' ' THR . 99.7 mt -55.35 -47.2 76.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.336 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.39 -28.28 66.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.0 m -62.94 -50.76 69.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.565 0.222 . . . . 0.0 110.807 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -65.1 -38.56 91.1 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-O 120.974 0.416 . . . . 0.0 110.276 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -58.76 -49.26 78.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.714 177.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.86 -44.51 96.91 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 123.141 0.576 . . . . 0.0 111.765 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.488 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.26 -38.08 82.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.903 0.382 . . . . 0.0 110.474 177.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -69.65 -38.87 77.3 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.544 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -79.65 -13.18 59.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.898 0.38 . . . . 0.0 111.884 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 . . . . . 0 C--N 1.316 -0.862 0 CA-C-O 120.918 0.389 . . . . 0.0 111.721 -175.744 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.0 mp -104.43 111.1 32.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.929 0.395 . . . . 0.0 110.151 178.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.732 ' HG ' HG13 ' A' ' 31' ' ' ILE . 2.8 mm? -70.04 -30.59 67.91 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.4 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -50.45 -40.4 50.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.79 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.401 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 23.7 m-20 -67.56 -55.3 14.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.61 -177.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.87 86.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.57 -176.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.0 mt -64.06 -44.86 97.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.268 -177.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 69.9 mtp -81.88 -9.04 59.71 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.485 -176.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -77.39 -38.9 48.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.64 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 61.9 tttm -81.35 -38.19 27.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.239 177.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.53 ' HB2' ' HB2' ' A' ' 14' ' ' ALA . 85.1 m-85 -121.08 98.58 47.16 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.536 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.77 -24.49 68.64 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.609 2.206 . . . . 0.0 111.973 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -98.53 17.86 18.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.043 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.53 ' HB2' ' HB2' ' A' ' 11' ' ' TYR . . . -86.76 101.41 13.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.141 0.496 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 37.7 t -88.79 117.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.449 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 p -72.04 150.6 43.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.468 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 64.88 23.05 12.59 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -125.05 -72.06 0.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.037 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.7 t0 -109.25 4.83 23.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.786 0.803 . . . . 0.0 110.022 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.495 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 39.6 p90 -165.27 127.18 2.07 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 171.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -113.33 130.42 56.27 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.126 0.489 . . . . 0.0 111.169 -172.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.34 153.2 24.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.667 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.508 ' NH1' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -133.32 173.96 10.91 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.246 0.546 . . . . 0.0 111.208 176.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -99.52 123.62 43.96 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.204 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.434 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 7.1 t70 -98.19 -34.64 10.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.224 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.74 -29.14 5.94 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -174.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -100.36 -8.93 22.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.611 0.72 . . . . 0.0 109.588 175.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.8 177.42 30.89 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.776 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.2 m -96.13 115.48 27.5 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.434 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 53.5 p90 -106.17 171.24 7.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.806 -172.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.732 HG13 ' HG ' ' A' ' 3' ' ' LEU . 58.5 mt -87.45 118.71 33.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.977 176.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.508 ' HG2' ' NH1' ' A' ' 23' ' ' ARG . 8.9 tp10 -101.97 -56.55 2.25 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.78 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -121.29 113.09 19.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.336 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.442 ' CH2' HD12 ' A' ' 36' ' ' LEU . 58.1 t-105 -106.83 112.53 25.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.173 -174.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 6.1 m-20 -110.86 1.94 17.94 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -177.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.442 HD12 ' CH2' ' A' ' 34' ' ' TRP . 90.7 mt -69.57 141.42 53.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.32 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -82.59 41.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.489 0.661 . . . . 0.0 110.748 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.13 142.17 40.84 Favored Pre-proline 0 C--N 1.315 -0.935 0 CA-C-N 115.104 -0.953 . . . . 0.0 108.774 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.4 155.74 50.54 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.381 2.054 . . . . 0.0 111.962 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.4 mm? -65.8 120.55 69.75 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.598 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -62.69 168.83 9.47 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.918 2.412 . . . . 0.0 112.117 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.4 p -94.1 167.03 11.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.74 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -62.57 -44.19 96.93 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.898 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.79 -45.05 86.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.208 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -57.7 -54.11 50.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.818 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.451 ' HA ' ' CE3' ' A' ' 49' ' ' TRP . 93.3 mt -55.21 -46.21 75.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.826 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.77 -20.77 59.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -177.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 88.5 m -70.83 -44.35 66.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.107 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.64 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 9.5 m0 -64.31 -36.97 85.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.424 ' O ' ' HB2' ' A' ' 54' ' ' GLN . 62.0 t-105 -60.97 -42.75 98.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.312 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -70.51 -43.39 69.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.23 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -61.8 -40.78 96.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.401 ' CD2' ' HB3' ' A' ' 5' ' ' ASP . 58.5 tp -68.38 -34.35 75.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.525 176.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' A' ' 50' ' ' TRP . 0.4 OUTLIER -72.61 -25.17 61.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.063 0.458 . . . . 0.0 110.541 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 74.5 tttt -78.65 -6.76 56.55 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.506 175.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.3 t30 . . . . . 0 N--CA 1.465 0.313 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.284 -174.452 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.429 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 1.3 tmt? . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.423 HG22 ' H ' ' A' ' 4' ' ' TYR . 4.4 mp -106.28 124.52 61.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.267 -177.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.626 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 0.2 OUTLIER -65.86 -32.98 74.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.515 179.435 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.456 ' HE1' ' OG ' ' A' ' 16' ' ' SER . 81.8 t80 -52.17 -47.63 65.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.258 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.455 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 0.9 OUTLIER -60.4 -47.81 84.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.401 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.89 99.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.12 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 3' ' ' LEU . 82.1 mt -63.49 -43.25 98.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.15 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 30.6 mmt -67.71 -23.29 65.26 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.165 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -81.39 -37.7 27.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.938 0.399 . . . . 0.0 110.437 177.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -82.78 -50.81 8.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.382 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -132.33 88.02 41.13 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.467 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -68.35 -13.12 36.89 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.744 2.296 . . . . 0.0 111.3 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -75.93 -13.74 60.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.875 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.9 137.63 32.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.549 ' HB ' ' HD3' ' A' ' 18' ' ' LYS . 47.7 t -99.34 129.36 49.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.89 0.376 . . . . 0.0 110.743 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.456 ' OG ' ' HE1' ' A' ' 4' ' ' TYR . 14.9 m -62.92 134.4 56.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.253 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 70.8 3.98 4.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.533 0.733 . . . . 0.0 111.553 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.549 ' HD3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -110.96 -63.84 1.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.851 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.544 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 52.5 m-20 -90.0 -17.71 27.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.288 -177.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.2 p90 -153.51 130.35 10.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.517 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 33.2 tt0 -109.79 126.39 53.72 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 mt -90.77 150.85 21.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.612 0.72 . . . . 0.0 111.542 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -139.68 154.75 47.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.502 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -86.3 123.7 31.84 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.057 0.456 . . . . 0.0 110.783 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.468 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 1.7 t70 -88.86 -32.69 17.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.325 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.07 -43.61 1.52 Allowed Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -79.5 -20.03 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.451 0.644 . . . . 0.0 109.579 173.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.429 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 163.72 -172.07 39.52 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.317 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -88.19 121.66 30.84 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.626 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.3 p90 -117.94 -178.06 3.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.447 -0.205 . . . . 0.0 110.447 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.441 HD11 HD11 ' A' ' 7' ' ' ILE . 31.0 mt -91.11 121.6 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.972 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -98.65 -53.33 3.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.517 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 2.8 tppp? -94.76 104.52 16.43 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.351 178.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 61.5 t-105 -87.03 108.89 19.06 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 168.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -106.91 -2.97 20.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.463 0.649 . . . . 0.0 110.41 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.544 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 73.2 mt -86.95 147.62 25.68 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.873 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.2 mtp180 -92.57 36.2 1.01 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.474 ' HB1' ' HD2' ' A' ' 39' ' ' PRO . . . -111.2 161.74 23.83 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 114.41 -1.268 . . . . 0.0 109.943 -177.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' 38' ' ' ALA . 30.8 Cg_endo -64.39 150.05 88.97 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.642 2.228 . . . . 0.0 112.468 178.389 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.58 134.08 51.64 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.898 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.412 ' HB3' ' CH2' ' A' ' 49' ' ' TRP . 43.0 Cg_endo -68.97 164.37 33.98 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.487 2.125 . . . . 0.0 111.375 172.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.604 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 70.3 p -95.87 167.63 11.13 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.704 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.519 HE21 ' HG3' ' A' ' 47' ' ' GLU . 23.2 tp60 -55.88 -46.81 78.22 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.343 0.592 . . . . 0.0 109.534 173.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.75 70.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.847 176.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.01 -46.62 87.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.415 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 42' ' ' THR . 87.4 mt -57.08 -44.52 83.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.909 0.385 . . . . 0.0 111.023 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.519 ' HG3' HE21 ' A' ' 43' ' ' GLN . 48.6 mt-10 -75.02 -24.64 58.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.056 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.8 m -73.07 -41.43 64.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.398 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.412 ' CH2' ' HB3' ' A' ' 41' ' ' PRO . 51.2 m0 -66.58 -31.98 73.03 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -64.46 -36.11 83.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.944 174.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.11 -50.25 49.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.295 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -62.22 -32.79 73.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.694 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.455 ' CD2' ' HB3' ' A' ' 5' ' ' ASP . 44.9 tp -61.11 -43.06 99.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.036 176.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -76.65 -31.62 57.45 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.491 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -74.01 -15.17 61.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.892 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.4 t30 . . . . . 0 C--N 1.317 -0.811 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.3 179.495 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.456 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.601 HG23 ' HB2' ' A' ' 29' ' ' SER . 4.2 mp -108.47 128.86 63.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.208 -177.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.45 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -66.12 -32.55 74.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.399 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.508 ' H ' HG22 ' A' ' 2' ' ' ILE . 84.3 t80 -52.39 -45.56 65.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.685 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.36 -49.94 75.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 0.0 111.201 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.32 -45.08 95.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.295 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.29 -47.08 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.888 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.26 -29.64 70.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.83 -177.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -68.23 -45.34 73.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.048 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 10' ' ' LYS . 21.9 tptm -81.17 -35.8 30.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.887 -178.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -121.72 89.03 47.51 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.554 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -66.39 -22.01 53.05 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.983 2.455 . . . . 0.0 112.336 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -102.8 23.99 11.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.235 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.53 106.28 18.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.596 HG11 ' HD2' ' A' ' 18' ' ' LYS . 19.5 t -76.47 113.59 15.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.153 0.502 . . . . 0.0 111.201 -175.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.3 p -66.81 139.01 57.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.742 -178.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 68.8 6.93 5.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.448 -0.797 . . . . 0.0 112.099 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.596 ' HD2' HG11 ' A' ' 15' ' ' VAL . 50.1 mttp -119.18 -55.49 2.15 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.842 0.353 . . . . 0.0 110.265 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.455 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 10.7 t70 -91.66 -50.32 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.95 178.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -120.27 141.08 50.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.646 176.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.647 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 80.4 tt0 -129.51 131.09 46.55 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -177.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 mt -112.53 153.54 27.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.796 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.416 ' HD3' ' HA ' ' A' ' 23' ' ' ARG . 9.7 tpp180 -123.12 157.01 33.83 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.421 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -98.97 132.09 44.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.085 0.469 . . . . 0.0 111.357 -171.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -90.97 -48.3 7.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.689 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.55 -47.37 0.93 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -173.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -92.4 6.19 47.92 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.654 0.74 . . . . 0.0 109.695 174.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.456 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 161.93 -164.92 35.59 Favored Glycine 0 N--CA 1.441 -0.977 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.674 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.601 ' HB2' HG23 ' A' ' 2' ' ' ILE . 18.4 m -130.16 136.34 49.17 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 46.4 p90 -120.6 173.1 7.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.986 -173.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.45 HG13 ' HG ' ' A' ' 3' ' ' LEU . 29.7 mt -95.78 137.25 24.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.507 -175.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -129.46 -22.96 2.98 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.831 0.348 . . . . 0.0 111.184 167.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.647 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 20.7 mmtp -117.15 135.7 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.417 177.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -154.43 111.67 3.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -110.39 -9.97 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.783 179.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.455 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 69.5 mt -56.62 133.27 53.59 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.174 0.512 . . . . 0.0 111.372 -178.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -80.84 51.44 1.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.384 -178.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.18 144.42 31.52 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.159 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.29 148.06 93.9 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.725 2.283 . . . . 0.0 112.3 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.2 mm? -65.28 133.77 95.6 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.944 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.63 169.21 21.59 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.974 2.449 . . . . 0.0 112.201 178.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.527 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 23.4 p -99.96 166.83 10.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -62.89 -39.03 93.25 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.53 91.14 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.423 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.88 -44.53 96.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.884 177.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 42' ' ' THR . 98.6 mt -59.74 -44.25 93.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.849 178.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 43' ' ' GLN . 53.3 mt-10 -60.94 -40.21 92.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.008 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.401 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 7.9 m -64.82 -48.12 75.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.47 -177.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -62.8 -35.03 78.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.152 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.521 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -61.5 -53.26 58.79 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.83 -43.53 90.71 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 48' ' ' THR . 42.4 mt-10 -58.77 -46.62 87.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.883 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 55.4 tp -62.27 -31.85 72.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.213 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.6 mm-40 -79.98 -39.19 30.61 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.502 -178.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -84.29 -16.91 41.37 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 C--N 1.311 -1.09 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.695 -179.036 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.484 1.264 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.4 mp -106.34 106.4 20.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.994 0.426 . . . . 0.0 110.342 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.6 mm? -70.79 -32.67 69.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.41 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -51.37 -54.21 28.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.431 -175.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.404 ' HB2' ' HZ3' ' A' ' 50' ' ' TRP . 5.7 m-20 -63.89 -47.84 79.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.49 -179.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.51 -49.53 74.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -69.11 -42.05 81.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.122 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 tpt -63.74 -35.37 80.36 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.965 0.412 . . . . 0.0 110.816 -177.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -70.82 -43.66 68.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.129 178.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.427 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 6.3 tmtm? -70.72 -47.22 60.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.741 -176.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.427 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 80.3 m-85 -120.64 92.39 47.85 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.296 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -63.87 -27.56 67.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.463 2.109 . . . . 0.0 112.396 -178.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -94.27 12.75 25.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.424 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.88 122.35 33.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.192 0.52 . . . . 0.0 110.156 175.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -100.27 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.148 -176.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.43 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 9.2 p -84.07 39.96 0.73 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 122.003 0.906 . . . . 0.0 111.474 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.476 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 77.2 mtt180 -95.49 -72.59 0.62 Allowed 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.315 176.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.476 ' HD2' ' HB3' ' A' ' 17' ' ' ARG . 3.3 mptp? -114.66 -37.09 4.34 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.6 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.31 -44.15 88.45 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.825 0.822 . . . . 0.0 109.957 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.43 ' O ' ' HA ' ' A' ' 16' ' ' SER . 20.4 p90 -148.92 149.04 30.54 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 168.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -136.7 133.02 35.68 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.263 0.554 . . . . 0.0 110.958 -174.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.3 mt -94.85 153.92 17.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.116 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -135.22 154.21 51.66 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -178.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -75.24 123.74 25.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.548 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 11.7 t70 -87.35 -28.35 22.27 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.715 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.15 -43.56 1.69 Allowed Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 -173.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -100.31 10.67 40.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.977 0.894 . . . . 0.0 109.099 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.14 -160.55 30.53 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.779 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.507 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 19.3 m -130.92 121.51 25.31 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.548 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -125.74 -179.17 4.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.841 0.353 . . . . 0.0 110.924 -173.548 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.3 mt -84.04 118.99 32.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.144 0.497 . . . . 0.0 111.318 -175.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -90.14 -56.22 3.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.002 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -115.84 148.4 39.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.885 -178.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -150.44 111.39 4.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.267 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -120.05 7.38 10.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.044 0.45 . . . . 0.0 110.505 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.3 147.6 51.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -86.88 51.15 2.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.619 0.723 . . . . 0.0 109.983 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.32 146.33 57.51 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.302 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.45 136.61 77.06 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.865 2.377 . . . . 0.0 112.581 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.85 116.94 24.12 Favored Pre-proline 0 C--N 1.333 -0.138 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -60.47 151.0 78.09 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.672 2.248 . . . . 0.0 112.164 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.5 p -99.34 175.43 5.87 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.416 -178.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -53.79 -52.29 60.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.174 0.511 . . . . 0.0 110.759 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.63 -48.1 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -58.92 -49.94 75.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.496 HD22 HD11 ' A' ' 3' ' ' LEU . 80.2 mt -57.87 -49.11 77.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.207 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 42.4 mt-10 -69.15 -33.53 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.833 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -62.48 -41.9 99.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.682 0.277 . . . . 0.0 110.883 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -66.83 -35.2 79.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 110.257 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.404 ' HZ3' ' HB2' ' A' ' 5' ' ' ASP . 76.9 t-105 -66.66 -40.89 88.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.964 174.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.0 mt-10 -63.21 -43.9 96.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.264 177.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 39.0 mt-10 -62.33 -40.34 96.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.443 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 tp -65.94 -40.42 91.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.053 0.454 . . . . 0.0 110.454 176.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -66.0 -32.08 73.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.376 0.608 . . . . 0.0 110.615 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 46.5 tttm -100.06 14.23 31.35 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.856 -178.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 64.0 t30 . . . . . 0 C--N 1.324 -0.523 0 O-C-N 122.145 -0.347 . . . . 0.0 111.175 -177.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.6 mp -104.79 112.59 39.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.898 0.38 . . . . 0.0 110.434 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.51 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.6 mm? -70.41 -32.56 70.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.805 -178.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.499 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . 70.0 t80 -49.89 -52.42 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.74 -173.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.546 ' HB3' HD13 ' A' ' 53' ' ' LEU . 6.2 m-20 -66.76 -49.39 66.08 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.855 -177.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.23 -44.54 75.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.824 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 3' ' ' LEU . 73.2 mt -66.95 -48.83 78.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.694 -176.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.2 mtp -74.37 -22.26 59.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.161 -174.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -71.98 -37.81 69.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.093 0.473 . . . . 0.0 110.19 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -79.21 -48.92 13.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.993 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -116.14 101.17 53.94 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.914 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.41 -14.5 28.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.771 2.314 . . . . 0.0 112.369 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -94.13 4.97 53.15 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.219 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -100.69 117.73 35.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.757 0.313 . . . . 0.0 110.441 -177.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.565 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 45.3 t -95.77 129.29 46.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.832 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -68.15 139.49 56.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.0 mtt-85 66.54 6.06 4.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.59 -177.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.565 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -109.95 -64.95 1.2 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.487 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 46.2 m-20 -93.08 -25.64 17.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.913 -176.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.505 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 44.9 p90 -147.91 131.82 17.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.427 177.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.852 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 31.2 tt0 -120.06 134.97 55.1 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.499 ' CD1' ' HB2' ' A' ' 4' ' ' TYR . 35.9 mt -95.79 153.67 17.62 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.656 -170.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.0 162.8 34.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.648 175.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 -100.16 135.4 41.65 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 120.835 0.35 . . . . 0.0 110.647 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.422 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 12.9 t70 -99.39 -42.01 7.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.289 0.566 . . . . 0.0 109.996 175.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.45 -63.22 0.16 Allowed Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 -178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -112.0 17.4 19.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.584 0.706 . . . . 0.0 110.104 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -170.52 163.87 37.09 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.873 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.436 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 16.3 m -115.92 116.17 27.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 19.8 p90 -113.55 -175.96 2.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.587 -175.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 mt -89.96 126.48 42.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.799 0.333 . . . . 0.0 111.649 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -104.9 -56.17 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 172.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.852 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 17.3 mmtm -85.91 104.27 15.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.928 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.402 ' CH2' HD12 ' A' ' 36' ' ' LEU . 28.9 t-105 -101.95 112.34 24.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 174.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.487 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 30.8 m-80 -116.39 17.24 15.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.288 -175.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.402 HD12 ' CH2' ' A' ' 34' ' ' TRP . 87.9 mt -106.67 149.62 27.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.395 179.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -89.46 35.93 0.83 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.293 0.568 . . . . 0.0 110.064 177.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . . . -114.51 141.8 27.17 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.345 -176.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 38' ' ' ALA . 22.0 Cg_exo -64.57 141.92 75.43 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 123.109 2.539 . . . . 0.0 111.852 175.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 4.0 mm? -66.75 138.37 95.34 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.583 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 40' ' ' LEU . 6.2 Cg_exo -77.39 -174.84 2.37 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.22 2.614 . . . . 0.0 112.248 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.471 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 82.1 p -105.04 170.86 7.63 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.442 -178.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.27 -48.08 81.49 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.144 0.278 . . . . 0.0 110.922 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.47 -44.09 72.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.04 -55.17 38.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.398 177.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.5 mt -56.41 -47.14 79.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.9 -29.54 67.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.089 -176.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 87.9 m -67.24 -44.2 80.02 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.376 178.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.437 ' CZ3' HD23 ' A' ' 46' ' ' LEU . 25.3 m0 -60.82 -45.17 95.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.157 0.503 . . . . 0.0 109.88 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.4 t-105 -59.27 -47.92 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.771 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.04 -41.46 95.19 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.167 -0.469 . . . . 0.0 112.243 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -60.12 -40.87 91.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.768 0.318 . . . . 0.0 110.713 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.546 HD13 ' HB3' ' A' ' 5' ' ' ASP . 9.9 tt -64.96 -42.19 94.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.778 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -69.01 -35.89 77.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.274 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -92.18 6.56 46.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.032 -175.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 54.3 t30 . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.824 178.273 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.4 HG22 ' HB3' ' A' ' 4' ' ' TYR . 3.1 mp -113.44 116.71 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.13 -32.35 73.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.926 0.393 . . . . 0.0 110.823 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.4 ' HB3' HG22 ' A' ' 2' ' ' ILE . 87.8 t80 -52.27 -48.42 65.3 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.1 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -61.63 -51.27 69.18 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.524 -178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.92 -46.35 88.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.569 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.407 HG21 ' CZ ' ' A' ' 20' ' ' PHE . 84.4 mt -67.65 -46.26 83.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.966 -178.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.478 ' HA ' ' HE2' ' A' ' 8' ' ' MET . 0.0 OUTLIER -66.03 -31.66 72.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.005 0.431 . . . . 0.0 110.694 -176.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.429 ' OH ' ' HB3' ' A' ' 52' ' ' GLU . 13.5 t80 -63.76 -51.64 63.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.112 177.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.4 tttp -81.75 -43.11 18.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.616 -174.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -123.03 94.08 47.61 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.937 0.398 . . . . 0.0 110.708 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.466 ' HA ' ' HE2' ' A' ' 8' ' ' MET . 61.2 Cg_endo -73.77 -18.11 22.34 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.675 2.25 . . . . 0.0 112.5 -177.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.39 1.73 43.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.295 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.445 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -87.26 143.47 27.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.1 0.476 . . . . 0.0 111.054 -179.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.443 HG12 ' H ' ' A' ' 17' ' ' ARG . 98.7 t -127.32 123.14 61.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.449 177.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -88.96 37.43 0.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.713 0.768 . . . . 0.0 111.475 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.443 ' H ' HG12 ' A' ' 15' ' ' VAL . 20.7 mtp180 -99.23 -55.86 2.57 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.596 170.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -105.47 -67.32 0.93 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.904 -168.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.537 ' HB3' HD21 ' A' ' 36' ' ' LEU . 3.9 m-20 -52.48 -39.69 61.48 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.54 -175.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.445 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 37.8 p90 -158.17 176.96 11.82 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 45.1 tt0 -152.47 148.8 27.84 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.931 0.396 . . . . 0.0 110.468 179.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 31' ' ' ILE . 17.2 mt -116.7 145.53 43.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.678 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.531 ' HD2' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mtt180 -141.99 148.44 38.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.256 0.551 . . . . 0.0 110.832 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -92.98 121.97 34.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.921 -175.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.75 -47.01 6.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.504 179.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.06 -35.25 1.86 Allowed Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -76.63 -25.56 53.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.921 0.867 . . . . 0.0 108.928 169.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 165.34 -175.09 41.19 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.251 -1.34 . . . . 0.0 111.549 -179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.5 m -108.35 108.97 20.17 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -121.66 -177.57 3.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.716 0.293 . . . . 0.0 111.315 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.427 ' HA ' HD23 ' A' ' 22' ' ' LEU . 13.2 mt -84.72 124.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.741 -175.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.531 ' HG2' ' HD2' ' A' ' 23' ' ' ARG . 0.6 OUTLIER -113.21 -18.92 11.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.849 0.357 . . . . 0.0 110.978 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.623 ' HB2' ' HZ2' ' A' ' 33' ' ' LYS . 3.8 ttmp? -126.38 140.81 52.21 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.0 t-105 -153.68 113.49 3.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.615 0.245 . . . . 0.0 110.624 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -117.79 -1.84 11.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.013 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 19' ' ' ASP . 88.0 mt -73.91 152.12 40.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.659 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.9 mtt180 -85.88 45.99 1.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.943 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.43 139.75 30.49 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.369 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.12 145.52 67.2 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.411 2.074 . . . . 0.0 111.469 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.2 mm? -65.7 127.38 93.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.782 -179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.432 ' HG2' HD21 ' A' ' 46' ' ' LEU . 30.5 Cg_endo -63.68 164.55 20.88 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.875 2.383 . . . . 0.0 112.028 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 p -97.2 172.29 7.9 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.342 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.406 HE21 ' HG3' ' A' ' 47' ' ' GLU . 26.4 tp60 -50.43 -55.2 16.86 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.093 179.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.85 77.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.135 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.86 -44.8 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.449 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.432 HD21 ' HG2' ' A' ' 41' ' ' PRO . 92.6 mt -61.55 -43.72 98.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.972 0.415 . . . . 0.0 111.21 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HG3' HE21 ' A' ' 43' ' ' GLN . 46.2 mt-10 -71.27 -29.02 64.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.294 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.1 m -62.98 -44.59 95.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.655 177.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.7 m0 -68.17 -37.45 81.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.419 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.584 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 66.4 t-105 -60.89 -49.4 77.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.788 174.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -58.32 -41.8 85.35 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.489 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.429 ' HB3' ' OH ' ' A' ' 9' ' ' TYR . 79.7 mt-10 -62.35 -45.51 92.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.012 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.425 HD13 ' HB2' ' A' ' 9' ' ' TYR . 67.3 tp -60.14 -32.77 71.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.787 0.327 . . . . 0.0 111.052 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.4 mm-40 -81.26 -40.57 23.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.815 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -85.17 -17.88 35.84 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.341 0.591 . . . . 0.0 112.39 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 . . . . . 0 C--N 1.307 -1.262 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.826 -177.559 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ttt . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.658 0.266 . . . . 0.0 110.717 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.438 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.1 mp -95.85 106.02 17.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.707 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.4 mm? -71.42 -32.77 68.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.33 -175.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.435 ' CD1' HD11 ' A' ' 22' ' ' LEU . 87.0 t80 -51.35 -51.8 51.25 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.945 -174.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.85 -46.8 86.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.982 0.42 . . . . 0.0 111.065 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.511 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -61.76 -47.09 86.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.596 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.8 mt -65.83 -42.14 91.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.489 ' HE2' ' HA ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -63.81 -28.69 70.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.432 178.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -71.15 -36.62 72.12 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.963 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.627 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 85.1 tttt -86.85 -36.75 18.28 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.239 -179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -129.55 88.96 48.44 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.787 0.327 . . . . 0.0 111.054 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.489 ' HA ' ' HE2' ' A' ' 8' ' ' MET . 73.0 Cg_endo -77.24 -21.35 11.97 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.709 2.272 . . . . 0.0 113.146 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.56 5.99 45.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.428 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.22 147.1 23.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.542 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 38.9 t -95.32 128.29 46.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.019 0.438 . . . . 0.0 111.058 -176.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.6 m -61.68 138.54 58.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.812 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.532 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 0.7 OUTLIER 69.95 -3.82 1.64 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.571 0.748 . . . . 0.0 111.92 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.542 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 61.6 tttp -112.17 -61.12 1.76 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.777 0.322 . . . . 0.0 110.426 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.413 ' HB3' HD21 ' A' ' 36' ' ' LEU . 28.6 m-20 -85.91 -37.17 19.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.379 0.609 . . . . 0.0 109.974 177.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -134.07 114.42 13.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.947 173.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.557 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 43.7 tt0 -96.54 141.56 29.68 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.488 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.435 HD11 ' CD1' ' A' ' 4' ' ' TYR . 44.1 mt -107.59 153.3 23.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.097 0.475 . . . . 0.0 111.589 -172.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.608 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 29.7 ttt180 -132.65 122.35 24.54 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.826 174.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.434 ' HA ' ' HA ' ' A' ' 29' ' ' SER . 47.5 t30 -97.19 116.02 28.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.186 0.517 . . . . 0.0 110.675 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -95.56 -11.62 27.05 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.557 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.52 -47.26 1.07 Allowed Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 -174.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -71.49 -17.39 62.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.732 0.777 . . . . 0.0 109.794 174.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 164.95 161.75 14.56 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.999 178.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' ASN . 19.7 m -99.76 108.72 21.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.707 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 43.0 p90 -111.71 -168.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.685 0.279 . . . . 0.0 111.117 -176.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -76.54 122.99 32.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.087 0.47 . . . . 0.0 111.833 -174.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.608 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 9.2 tp10 -96.06 -61.67 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.157 172.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.557 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -119.98 119.04 32.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.115 -176.526 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -99.55 111.07 23.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -115.51 11.32 15.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.49 0.662 . . . . 0.0 110.1 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.413 HD21 ' HB3' ' A' ' 19' ' ' ASP . 84.2 mt -89.73 140.03 29.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -82.65 44.93 0.93 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.476 0.655 . . . . 0.0 110.351 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.05 147.3 65.29 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.417 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -55.5 145.15 70.39 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 123.016 2.477 . . . . 0.0 112.654 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.74 125.02 85.43 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.155 177.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.415 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 13.2 Cg_endo -58.58 147.35 87.28 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.912 2.408 . . . . 0.0 113.087 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.429 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.7 p -83.49 157.98 22.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.208 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.531 HE21 ' HG3' ' A' ' 47' ' ' GLU . 16.8 tp60 -57.43 -42.85 83.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.12 0.486 . . . . 0.0 110.296 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.49 -51.85 66.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.412 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.69 -42.45 98.01 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.662 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.46 HD22 HD11 ' A' ' 3' ' ' LEU . 90.5 mt -54.26 -53.52 52.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.198 177.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.531 ' HG3' HE21 ' A' ' 43' ' ' GLN . 46.4 mt-10 -71.22 -18.99 62.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.627 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 95.0 m -70.97 -46.69 61.9 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 174.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.627 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.7 m0 -61.5 -40.72 95.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.995 0.426 . . . . 0.0 109.876 177.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -60.11 -44.38 94.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.376 176.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -60.53 -49.48 77.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.457 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -63.68 -35.69 81.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.727 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.99 -45.7 87.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.643 175.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -69.75 -27.97 65.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.024 0.44 . . . . 0.0 111.185 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -84.4 1.28 46.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.1 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.5 t30 . . . . . 0 N--CA 1.466 0.337 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.012 -179.776 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 120.576 0.227 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 30.4 mm -88.57 107.06 17.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 110.331 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.742 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.1 mm? -70.13 -35.57 74.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.873 0.368 . . . . 0.0 110.789 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.497 ' HB2' HD13 ' A' ' 22' ' ' LEU . 71.3 t80 -52.46 -50.65 62.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.924 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.473 ' OD1' HD11 ' A' ' 53' ' ' LEU . 0.7 OUTLIER -65.83 -38.36 88.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -174.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.54 -44.29 78.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.018 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 3' ' ' LEU . 87.9 mt -61.65 -49.21 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.427 179.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -69.56 -22.73 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.84 -177.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -67.66 -41.98 82.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -92.01 -40.11 11.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.255 -178.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -119.26 97.05 50.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.097 -176.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -74.61 -13.66 22.3 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.555 2.17 . . . . 0.0 111.419 175.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -87.4 2.2 51.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.441 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -87.3 105.35 17.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.958 0.409 . . . . 0.0 110.815 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.1 t -81.9 117.74 28.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.774 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m -69.36 149.87 47.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.578 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 64.83 22.41 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.525 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -146.06 -72.36 0.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.084 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.554 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 4.4 m-20 -80.41 -17.42 51.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.356 0.598 . . . . 0.0 110.429 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.441 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 40.3 p90 -160.07 144.81 14.79 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.092 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -118.91 131.21 56.04 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.729 0.3 . . . . 0.0 110.196 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' A' ' 4' ' ' TYR . 29.0 mt -102.77 153.35 20.25 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.457 ' O ' ' HA ' ' A' ' 29' ' ' SER . 4.1 mtt180 -137.4 148.24 46.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.675 174.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -89.33 126.88 35.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.222 -174.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.72 -13.07 16.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.54 -33.72 6.15 Favored Glycine 0 N--CA 1.453 -0.216 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -172.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -87.93 2.45 51.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.07 0.938 . . . . 0.0 109.1 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 130.86 176.12 14.29 Favored Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.449 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.457 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 19.3 m -104.69 122.5 45.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.767 0.317 . . . . 0.0 110.269 177.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.742 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 2.9 p90 -120.61 -179.75 4.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.353 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.83 120.68 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.416 -173.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -94.09 -58.33 2.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.165 0.507 . . . . 0.0 109.707 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -115.67 145.88 42.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.973 -178.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.2 t-105 -128.02 111.93 14.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.114 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -113.7 -2.83 13.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 -179.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.554 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 34.7 mt -66.02 140.75 58.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -84.85 39.53 0.76 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.683 0.754 . . . . 0.0 110.197 178.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -123.36 154.71 65.81 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.961 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -69.48 151.41 70.69 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.082 1.855 . . . . 0.0 112.222 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.0 mm? -71.24 116.66 49.24 Favored Pre-proline 0 N--CA 1.45 -0.467 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.17 175.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.408 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 33.3 Cg_endo -65.32 159.58 46.61 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.513 2.142 . . . . 0.0 112.224 178.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.2 p -92.29 167.58 11.91 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.45 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -55.5 -45.98 77.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.154 0.502 . . . . 0.0 110.005 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.84 91.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.178 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.3 -43.68 96.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.075 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.5 mt -60.17 -46.93 88.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.181 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -68.89 -24.44 64.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.338 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.9 m -63.68 -50.8 67.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.814 0.34 . . . . 0.0 110.779 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.408 ' HH2' ' HB3' ' A' ' 41' ' ' PRO . 8.8 m0 -70.46 -32.16 69.6 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.181 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -64.93 -41.85 95.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.783 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.38 -51.08 71.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.194 175.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -63.96 -30.84 71.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.071 0.462 . . . . 0.0 111.231 -178.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.473 HD11 ' OD1' ' A' ' 5' ' ' ASP . 6.6 tt -65.93 -38.25 88.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.154 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.74 -32.58 20.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.552 -178.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.99 -15.62 58.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.379 0.609 . . . . 0.0 110.578 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.9 t30 . . . . . 0 C--N 1.315 -0.911 0 CA-C-N 115.013 -0.994 . . . . 0.0 108.854 171.337 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.554 ' H ' HD12 ' A' ' 2' ' ' ILE . 4.1 mp -74.0 106.35 3.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.489 ' HG ' HG13 ' A' ' 31' ' ' ILE . 2.5 mm? -64.49 -34.96 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.731 -173.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -51.23 -47.02 62.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.479 -175.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -68.87 -51.23 42.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.986 0.422 . . . . 0.0 110.884 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.479 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -57.1 -45.74 83.16 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.058 -178.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.8 mt -65.69 -41.91 91.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -177.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 61.0 mtp -72.84 -19.14 61.37 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.101 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -74.65 -33.58 62.55 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 173.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -75.97 -54.45 6.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.679 178.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -120.69 91.95 47.58 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -63.43 -24.37 71.0 Favored 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.733 2.289 . . . . 0.0 112.817 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -93.76 10.67 32.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.809 0.338 . . . . 0.0 111.634 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -92.43 127.75 38.04 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.1 t -96.7 117.58 41.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-O 121.019 0.438 . . . . 0.0 111.192 -176.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -67.19 142.44 56.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 67.23 22.6 9.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.651 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -140.68 -69.41 0.39 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.065 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -93.35 -34.96 13.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.363 0.601 . . . . 0.0 109.609 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -130.47 132.27 45.58 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 170.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.614 ' HB2' ' HB3' ' A' ' 33' ' ' LYS . 49.0 mt-10 -114.19 127.8 56.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 121.265 0.555 . . . . 0.0 111.013 -175.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.466 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 25.5 mt -109.43 149.71 29.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.432 178.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.533 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mpt_? -130.7 164.66 24.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.903 0.382 . . . . 0.0 110.756 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -82.7 125.0 30.74 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.938 -174.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.428 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 15.8 t70 -91.1 -52.3 4.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.423 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 154.09 -35.32 0.72 Allowed Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.206 -176.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -121.4 34.45 5.19 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.83 179.78 17.11 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.788 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.8 m -113.21 137.53 51.33 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.428 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 21.7 p90 -121.6 175.57 6.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.727 0.299 . . . . 0.0 111.029 -176.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.489 HG13 ' HG ' ' A' ' 3' ' ' LEU . 39.9 mt -81.74 122.46 36.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.91 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.533 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -116.84 -33.05 4.91 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.569 175.324 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.614 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -124.18 133.08 53.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.55 0.214 . . . . 0.0 110.428 -179.019 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -134.34 109.49 8.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -108.25 -1.56 20.05 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.913 0.387 . . . . 0.0 110.711 -176.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.19 143.87 56.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.672 175.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -90.25 34.34 0.87 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.475 0.655 . . . . 0.0 109.949 -179.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -125.02 144.65 47.78 Favored Pre-proline 0 C--N 1.316 -0.888 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.739 -178.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -61.0 150.88 81.97 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.688 2.259 . . . . 0.0 112.287 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -66.41 139.76 96.35 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.656 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.97 166.12 19.45 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.846 2.364 . . . . 0.0 112.608 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.48 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 77.8 p -89.02 158.0 18.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.203 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -57.29 -43.58 83.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.281 0.562 . . . . 0.0 109.749 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.38 76.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.742 -1.117 . . . . 0.0 111.584 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.39 -41.35 96.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.745 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 42' ' ' THR . 95.8 mt -51.39 -50.0 60.45 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 111.132 176.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -62.23 -41.83 98.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.735 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.8 m -65.31 -34.69 78.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.378 -177.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.479 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 52.5 m0 -59.97 -45.86 91.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.022 0.439 . . . . 0.0 109.843 175.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 -62.45 -40.57 97.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.265 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.49 -50.29 73.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.069 177.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.06 -43.43 98.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.214 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.97 -36.0 82.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.508 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -34.35 33.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.243 -178.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -86.94 -11.05 51.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 . . . . . 0 C--N 1.315 -0.909 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.326 178.692 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.469 HG22 ' H ' ' A' ' 4' ' ' TYR . 3.8 mp -117.72 132.4 67.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.809 -179.156 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.402 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.9 mm? -59.66 -34.47 72.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.919 0.39 . . . . 0.0 111.579 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.469 ' H ' HG22 ' A' ' 2' ' ' ILE . 62.0 t80 -52.95 -53.24 52.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -60.86 -48.16 83.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.264 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.421 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -58.34 -51.0 71.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.614 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 3' ' ' LEU . 75.8 mt -62.39 -42.74 96.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.763 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -24.96 65.51 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.882 -176.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -72.21 -45.22 61.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.878 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.717 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 46.1 tttp -72.94 -49.86 26.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.66 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -115.62 94.8 41.56 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.888 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -67.54 -17.57 48.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.832 2.354 . . . . 0.0 111.814 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -95.85 9.51 40.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.909 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.868 ' HB1' ' HZ ' ' A' ' 20' ' ' PHE . . . -82.01 140.72 33.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.125 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.465 ' C ' ' H ' ' A' ' 17' ' ' ARG . 43.4 t -107.45 87.15 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.167 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 m -83.48 37.81 0.59 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 122.324 1.059 . . . . 0.0 109.581 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 15' ' ' VAL . 51.9 mtt180 -96.07 -53.96 3.47 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 113.517 -1.674 . . . . 0.0 111.137 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -145.05 -45.78 0.23 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.152 -163.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -61.94 -27.7 69.01 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.723 0.773 . . . . 0.0 109.514 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.868 ' HZ ' ' HB1' ' A' ' 14' ' ' ALA . 35.4 p90 -155.89 149.04 24.48 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.374 167.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 31.8 tt0 -145.04 146.11 31.74 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.301 -170.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 39.0 mt -97.34 151.93 19.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.3 mpt_? -136.75 168.4 19.6 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.227 175.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -87.58 126.01 34.69 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.47 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 19.9 t70 -102.22 -15.53 16.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.299 0.571 . . . . 0.0 109.99 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.43 -53.34 0.8 Allowed Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.64 10.25 21.26 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.302 0.572 . . . . 0.0 109.924 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 144.18 -170.76 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.234 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 40.2 m -102.1 123.84 46.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.829 0.347 . . . . 0.0 110.607 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.47 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.2 p90 -122.7 177.81 5.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.355 -176.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.4 mt -75.38 121.05 26.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.226 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.51 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 26.3 tt0 -122.21 -46.08 2.2 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.987 177.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 32.5 mtmt -89.82 131.55 35.71 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -151.2 110.72 3.99 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -175.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -107.11 1.86 24.49 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.525 -175.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.7 mt -91.65 145.93 24.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.453 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 37' ' ' ARG . 58.5 mtt180 -83.22 48.02 1.33 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.757 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.97 145.86 55.48 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.49 -178.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.93 145.16 61.04 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.344 2.03 . . . . 0.0 111.305 174.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.89 134.02 95.93 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.596 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.79 158.95 22.45 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.487 2.791 . . . . 0.0 112.924 -178.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 59.9 p -88.64 158.68 18.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.078 -175.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -53.64 -44.77 69.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.242 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.11 -51.89 67.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.59 -43.43 96.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.484 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.2 mt -53.93 -47.41 71.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.896 0.379 . . . . 0.0 111.231 178.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -72.53 -29.25 63.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.483 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.9 m -69.33 -41.22 76.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.871 176.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.717 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 37.9 m0 -60.08 -46.09 90.73 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 174.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -57.82 -48.74 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.593 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -56.84 -53.27 59.78 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.563 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -65.72 -30.36 71.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.442 -177.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.0 -38.79 89.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.909 0.385 . . . . 0.0 110.294 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.3 -30.9 38.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.161 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 45.4 tttt -79.46 -15.5 57.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.682 -178.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.0 t30 . . . . . 0 C--N 1.315 -0.933 0 N-CA-C 108.525 -0.916 . . . . 0.0 108.525 173.098 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.3 mp -97.51 112.7 30.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.206 0.527 . . . . 0.0 110.446 -178.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.5 HD11 HD13 ' A' ' 46' ' ' LEU . 2.4 mm? -65.71 -33.35 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.035 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -52.37 -54.18 35.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.907 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.91 -44.67 96.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.337 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.68 -51.41 69.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.421 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.56 -41.62 92.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.607 0.241 . . . . 0.0 110.745 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.59 -13.95 62.59 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.584 -179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -82.19 -40.24 22.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -76.99 -51.75 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.741 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -118.14 98.17 51.26 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.137 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.15 -31.33 54.54 Favored 'Trans proline' 0 CA--C 1.528 0.211 0 C-N-CA 123.032 2.488 . . . . 0.0 113.123 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -102.61 19.49 18.97 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -176.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.88 119.53 24.52 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.52 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.423 ' C ' ' H ' ' A' ' 17' ' ' ARG . 47.5 t -84.7 88.55 2.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.548 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.486 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 9.9 p -85.89 36.73 0.68 Allowed 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.459 1.123 . . . . 0.0 110.24 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 15' ' ' VAL . 93.8 mtt180 -97.29 -60.34 1.6 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 113.629 -1.623 . . . . 0.0 110.988 175.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.5 tttp -128.89 -43.09 1.37 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 111.655 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.611 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 5.6 t70 -65.26 -34.74 79.07 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.486 ' CE2' ' HB3' ' A' ' 16' ' ' SER . 14.1 p90 -143.44 132.08 22.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 164.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -105.13 141.72 36.18 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.744 -169.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.5 mt -113.49 152.71 29.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.687 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -144.91 174.57 10.9 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.126 0.488 . . . . 0.0 109.828 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -129.99 117.53 20.21 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.763 -176.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.92 -27.18 57.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.297 0.57 . . . . 0.0 109.703 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.54 -42.37 1.17 Allowed Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.637 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -99.47 -0.07 41.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.443 0.639 . . . . 0.0 110.644 -176.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 177.22 155.99 14.97 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.226 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.8 m -105.05 122.16 45.29 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -130.84 -179.3 5.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.983 -173.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.3 mt -87.36 132.81 31.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.585 ' HG3' ' HD2' ' A' ' 33' ' ' LYS . 13.1 pt-20 -111.63 -34.01 6.19 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.24 176.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HD2' ' HG3' ' A' ' 32' ' ' GLU . 10.1 mptt -126.02 148.71 49.23 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 175.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -144.04 111.61 6.03 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 90.1 m-20 -123.06 13.66 9.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.704 0.288 . . . . 0.0 110.643 -178.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.416 HD23 ' OD2' ' A' ' 19' ' ' ASP . 48.0 mt -66.22 153.45 42.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.183 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 37' ' ' ARG . 62.2 mtt180 -82.13 42.35 0.73 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.127 178.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -152.4 154.58 32.16 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.484 -177.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.94 171.1 17.31 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.327 2.018 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -79.51 135.63 56.7 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.794 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.63 173.51 12.45 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.724 2.282 . . . . 0.0 111.819 176.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.617 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 34.2 p -99.11 161.4 13.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.073 -177.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.66 -44.76 85.93 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.07 -45.86 89.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.363 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.51 -45.01 95.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.656 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.6 mt -50.89 -50.47 57.13 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.494 0.496 . . . . 0.0 111.476 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -71.28 -28.62 64.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -178.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.9 m -66.03 -38.9 89.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.88 0.371 . . . . 0.0 110.31 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -63.17 -42.98 99.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -61.89 -44.73 96.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.373 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -61.09 -46.98 88.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.427 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -66.98 -28.7 68.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.281 . . . . 0.0 111.372 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.86 -54.8 21.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.842 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.99 -32.41 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.555 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -95.85 27.61 3.46 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 32.4 p30 . . . . . 0 N--CA 1.469 0.525 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.425 -177.812 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.5 mmm . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.649 0.261 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.7 mm -87.53 110.76 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 2.3 mm? -69.22 -38.06 78.35 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.488 -175.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.407 ' CD1' HD11 ' A' ' 22' ' ' LEU . 27.7 t80 -54.73 -48.69 72.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.525 -176.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.4 -49.88 76.12 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.213 0.321 . . . . 0.0 111.016 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.407 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -59.88 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.587 -178.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.45 -43.55 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -23.13 66.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.855 -177.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -77.09 -48.61 17.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.194 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.93 -27.72 23.18 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.73 0.3 . . . . 0.0 110.649 -177.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -116.16 83.62 12.83 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -67.15 -28.46 40.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.904 2.403 . . . . 0.0 113.211 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -111.26 27.14 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.659 -174.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.65 141.91 34.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.64 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.522 ' HB ' ' HB2' ' A' ' 19' ' ' ASP . 41.6 t -81.02 103.72 8.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.063 0.458 . . . . 0.0 111.144 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.0 m -69.82 140.29 53.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.234 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.1 mtt-85 71.12 11.96 6.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.556 173.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -140.4 -59.66 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.796 0.331 . . . . 0.0 110.452 173.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.522 ' HB2' ' HB ' ' A' ' 15' ' ' VAL . 0.5 OUTLIER -76.39 -26.31 55.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.265 0.555 . . . . 0.0 110.024 176.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -142.25 114.4 8.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 166.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -94.14 136.12 34.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.582 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.407 HD11 ' CD1' ' A' ' 4' ' ' TYR . 23.3 mt -105.86 152.79 22.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.626 -175.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.848 HH11 ' HG2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -139.74 155.51 47.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.366 174.236 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -88.35 109.6 20.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.882 -178.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.543 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 28.1 t70 -84.82 -42.84 14.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.08 0.467 . . . . 0.0 111.205 -178.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.37 -39.09 0.93 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.675 -177.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -107.19 27.84 8.65 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.62 179.52 15.81 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.124 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 4.0 m -90.99 131.31 36.67 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.57 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 1.7 p90 -125.94 -177.95 4.12 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.0 mt -74.67 121.54 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.091 0.472 . . . . 0.0 111.449 -175.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.848 ' HG2' HH11 ' A' ' 23' ' ' ARG . 3.7 tp10 -100.22 -52.66 3.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 176.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -129.56 111.36 12.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.557 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -100.89 112.41 24.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 -177.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.466 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 80.6 m-20 -114.63 -6.12 12.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.621 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.462 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 36.5 mt -65.54 137.73 57.59 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.482 0.658 . . . . 0.0 111.278 -178.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -83.27 36.18 0.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.926 0.87 . . . . 0.0 109.901 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.409 ' H ' ' C ' ' A' ' 36' ' ' LEU . . . -125.08 147.48 57.15 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.458 -1.247 . . . . 0.0 109.751 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.08 144.61 94.6 Favored 'Trans proline' 0 C--O 1.238 0.525 0 C-N-CA 123.023 2.482 . . . . 0.0 113.011 178.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.403 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 4.3 mm? -66.31 126.86 92.79 Favored Pre-proline 0 N--CA 1.45 -0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.33 176.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.411 ' HB3' ' CH2' ' A' ' 49' ' ' TRP . 12.3 Cg_endo -57.69 150.83 59.29 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.019 2.479 . . . . 0.0 112.564 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 p -102.72 168.6 9.14 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.896 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -56.59 -54.57 44.48 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.938 -178.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.98 85.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.027 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.579 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 34.0 mt-10 -57.44 -54.34 47.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.982 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.5 mt -51.68 -49.39 62.48 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.585 -178.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.19 -31.86 68.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.649 -177.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.2 m -67.36 -44.33 79.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.901 178.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.579 ' CZ2' ' HB3' ' A' ' 45' ' ' GLU . 15.5 m0 -64.18 -39.49 94.12 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.585 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -60.31 -49.14 78.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.173 176.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -62.36 -43.89 97.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.717 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.98 -36.55 83.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.239 -0.184 . . . . 0.0 110.742 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -64.18 -39.91 94.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.806 0.336 . . . . 0.0 110.504 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.585 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 26.9 mm-40 -66.9 -37.18 83.89 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.424 0.631 . . . . 0.0 109.963 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -86.97 5.63 36.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.043 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.7 t30 . . . . . 0 C--N 1.323 -0.547 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.19 -176.048 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.6 0.238 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 59.2 mt -119.39 128.76 75.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.482 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.8 mm? -67.19 -37.58 83.92 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.248 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -52.44 -46.61 66.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.471 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.65 -47.31 85.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.828 0.347 . . . . 0.0 111.12 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.4 95.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.397 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.7 mt -63.37 -40.74 90.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.63 179.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.9 mmt -68.46 -21.93 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.74 0.305 . . . . 0.0 111.313 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -74.67 -43.44 55.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 0.0 110.541 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -90.81 -35.33 14.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.687 -175.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -121.6 84.55 42.81 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.542 0.21 . . . . 0.0 111.253 -176.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -70.9 -22.9 26.25 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.895 2.397 . . . . 0.0 112.782 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -95.94 8.36 43.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.452 -176.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.99 139.89 31.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.2 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 t -106.16 127.6 61.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 CA-C-O 121.118 0.485 . . . . 0.0 111.108 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.7 p -73.09 152.67 41.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.034 176.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.1 mtm180 65.25 17.04 10.86 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.208 0.527 . . . . 0.0 109.96 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -141.58 -73.73 0.32 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.468 -174.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.406 ' HB3' HD21 ' A' ' 36' ' ' LEU . 53.9 m-20 -80.34 -29.71 38.0 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.453 0.644 . . . . 0.0 109.857 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -139.93 136.18 33.58 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.918 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.712 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 5.8 tp10 -96.61 127.24 42.41 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.273 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.7 mt -100.69 153.46 19.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.977 0.417 . . . . 0.0 110.126 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -129.71 142.2 50.75 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -94.73 109.99 21.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.114 0.483 . . . . 0.0 110.878 -176.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -79.02 -39.2 34.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.399 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.19 -42.22 1.64 Allowed Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -173.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -89.13 -5.89 57.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.856 0.836 . . . . 0.0 109.024 173.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 167.93 -177.89 41.98 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.44 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 21.3 m -120.34 130.59 54.49 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.4 p90 -124.4 -179.77 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.248 0.343 . . . . 0.0 111.231 -176.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.7 mt -84.85 121.41 36.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.365 0.602 . . . . 0.0 111.466 -173.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -96.9 -58.29 2.07 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.296 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.712 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 9.7 ttmm -113.58 138.67 49.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.206 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -125.83 112.16 15.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -116.31 11.03 14.93 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.901 0.381 . . . . 0.0 111.41 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 19' ' ' ASP . 66.6 mt -87.69 144.29 26.73 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.901 0.382 . . . . 0.0 111.124 -178.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -81.5 62.88 5.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.43 0.633 . . . . 0.0 109.811 174.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.22 143.65 19.69 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.577 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.31 146.89 93.34 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 122.578 2.185 . . . . 0.0 111.817 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.82 118.91 62.46 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.342 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.18 146.02 97.22 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.692 2.262 . . . . 0.0 112.548 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 9.2 p -93.82 171.75 8.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.738 -177.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.559 HE21 ' HG3' ' A' ' 47' ' ' GLU . 21.6 tp60 -53.78 -51.69 62.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.694 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.08 -42.56 76.89 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.276 178.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -50.02 72.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.957 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.9 mt -58.05 -44.48 87.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.682 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.559 ' HG3' HE21 ' A' ' 43' ' ' GLN . 42.6 mt-10 -65.13 -44.06 89.88 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.103 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -59.06 -43.67 91.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -61.28 -40.74 95.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.355 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.0 t-105 -66.29 -44.08 84.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.123 177.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 64.5 mt-10 -61.28 -42.4 98.59 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.887 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.34 -30.81 62.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.767 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.4 tp -77.57 -40.01 43.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.01 0.433 . . . . 0.0 111.025 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -83.47 -23.22 32.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -86.99 -16.02 36.98 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.361 0.6 . . . . 0.0 110.385 176.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -133.27 99.43 14.68 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.309 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.05 126.93 19.01 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.275 1.984 . . . . 0.0 111.306 178.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -57.87 149.54 68.99 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.614 2.209 . . . . 0.0 111.572 178.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -81.31 87.58 6.13 Favored 'General case' 0 C--N 1.321 -0.63 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 . . . . . 0 C--N 1.316 -0.864 0 CA-C-N 114.432 -1.258 . . . . 0.0 110.495 -179.244 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.436 ' SD ' ' HG2' ' A' ' 47' ' ' GLU . 18.0 ptt? . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.054 0.454 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.67 125.76 73.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.549 HD11 HD13 ' A' ' 46' ' ' LEU . 4.0 mm? -61.04 -40.29 93.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.7 -176.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.574 ' HB2' HD11 ' A' ' 22' ' ' LEU . 15.1 t80 -55.2 -51.68 65.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.222 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -60.76 -46.86 88.83 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.369 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.85 84.15 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.337 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.5 HD11 HD11 ' A' ' 31' ' ' ILE . 70.3 mt -67.27 -45.55 85.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 -179.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.2 mmt -65.96 -27.83 68.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.618 -176.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -75.95 -42.21 49.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.028 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.56 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 9.4 tmtt? -84.49 -36.57 22.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.827 -176.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.56 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 92.4 m-85 -127.62 88.23 54.08 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.008 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.84 -20.53 17.16 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.684 2.256 . . . . 0.0 112.266 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -86.24 5.59 33.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.892 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.65 129.67 37.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.2 t -90.37 110.28 21.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.35 0.595 . . . . 0.0 111.405 -175.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 20' ' ' PHE . 22.1 p -79.85 162.06 25.26 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 63.57 23.04 13.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.595 0.712 . . . . 0.0 110.116 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -145.89 -68.21 0.28 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.788 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.586 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 27.2 m-20 -88.93 -52.78 4.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.392 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.662 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 41.3 p90 -117.62 130.2 56.23 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.315 0.578 . . . . 0.0 111.411 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.767 ' HB2' ' HB2' ' A' ' 33' ' ' LYS . 2.0 mp0 -129.6 161.69 29.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.228 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 4' ' ' TYR . 46.5 mt -96.57 154.38 17.31 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.621 0.724 . . . . 0.0 111.971 -173.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.613 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 1.8 tpt180 -134.24 156.37 48.52 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -89.89 120.68 31.32 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.515 -0.474 . . . . 0.0 111.115 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.611 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 23.3 t70 -92.27 -23.93 19.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.923 177.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.8 -47.97 0.99 Allowed Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.201 -175.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.585 0.707 . . . . 0.0 109.869 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 169.43 -179.87 41.71 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.596 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 m -98.29 119.27 36.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.611 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 24.6 p90 -110.04 -179.44 3.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.842 0.353 . . . . 0.0 111.034 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.5 HD11 HD11 ' A' ' 7' ' ' ILE . 35.3 mt -91.03 123.01 43.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.797 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.613 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 2.1 tm-20 -119.93 -52.99 2.19 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.767 ' HB2' ' HB2' ' A' ' 21' ' ' GLU . 2.7 mmmp? -78.6 113.67 16.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.634 173.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -134.76 110.34 9.15 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.586 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 2.1 m-20 -118.91 4.17 11.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.196 -178.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.3 mt -73.78 141.23 46.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.072 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -79.96 46.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.341 0.591 . . . . 0.0 110.803 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.48 145.82 30.28 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.881 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.24 155.21 51.72 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.653 2.235 . . . . 0.0 112.441 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.0 mm? -71.66 137.08 83.02 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.161 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.529 ' HG2' HD21 ' A' ' 46' ' ' LEU . 74.4 Cg_endo -76.25 -177.91 4.03 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.078 2.518 . . . . 0.0 112.098 175.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.457 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 40.5 p -98.64 164.82 12.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.935 -177.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.423 ' HA ' HD12 ' A' ' 46' ' ' LEU . 5.8 tt0 -60.44 -46.03 91.51 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 110.038 -178.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.43 -48.09 74.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -56.95 -51.22 70.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.257 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.549 HD13 HD11 ' A' ' 3' ' ' LEU . 68.2 mt -54.88 -50.82 67.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.438 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 48.2 mt-10 -66.75 -33.35 75.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.509 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.9 m -65.87 -37.9 87.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.539 0.209 . . . . 0.0 110.705 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.472 ' CE2' ' HG3' ' A' ' 10' ' ' LYS . 22.1 m0 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.715 0.293 . . . . 0.0 110.244 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -60.92 -44.55 97.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.205 0.526 . . . . 0.0 110.03 173.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.9 mt-10 -61.38 -46.66 89.28 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.14 177.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 51.7 mt-10 -63.33 -42.28 98.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.855 178.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.1 tp -57.87 -43.94 86.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.916 0.389 . . . . 0.0 111.191 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -75.56 -33.12 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.908 -174.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 48.0 tttm -84.59 -7.48 59.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.04 0.448 . . . . 0.0 111.577 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 5.0 t30 -96.14 142.82 25.1 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.768 -174.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -59.66 165.37 9.87 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.137 2.558 . . . . 0.0 111.994 172.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -68.88 174.21 9.06 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.621 2.214 . . . . 0.0 112.162 178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -71.03 102.74 2.51 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.921 -175.771 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.483 1.218 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.439 ' H ' HD12 ' A' ' 2' ' ' ILE . 4.3 mp -78.87 104.42 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.484 0.659 . . . . 0.0 110.434 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -71.12 -31.92 68.36 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.265 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -51.04 -53.89 29.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.378 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.417 ' HB3' HD21 ' A' ' 53' ' ' LEU . 1.8 m-20 -64.52 -42.4 95.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.472 -178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB1' ' HB3' ' A' ' 49' ' ' TRP . . . -59.87 -44.22 94.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.724 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 3' ' ' LEU . 83.5 mt -61.84 -42.17 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.579 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.4 mmt -66.34 -22.88 66.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.957 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -71.93 -45.99 59.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -87.75 -42.45 12.6 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.282 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -117.84 86.96 25.93 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 116.66 -0.245 . . . . 0.0 110.788 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.64 -26.84 22.99 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.742 2.295 . . . . 0.0 112.825 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -91.33 12.13 21.44 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.83 132.71 40.81 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 176.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.0 t -101.56 127.15 55.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.9 m -67.22 141.85 57.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.044 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ttm-85 61.79 22.77 13.26 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.917 0.887 . . . . 0.0 111.225 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -135.0 -62.21 0.73 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.264 172.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.461 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 47.0 m-20 -89.93 -27.68 19.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.051 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -152.06 144.36 24.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.807 177.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 39.8 tt0 -126.6 136.17 52.19 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 mt -89.83 154.08 20.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.939 -176.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 32' ' ' GLU . 9.3 tpp180 -136.45 153.35 51.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.582 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -87.07 112.39 21.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.895 0.378 . . . . 0.0 110.354 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.538 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 19.4 t70 -82.51 -21.07 35.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.488 0.661 . . . . 0.0 110.262 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.12 -41.06 2.34 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -170.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -78.59 -6.46 55.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.062 -0.569 . . . . 0.0 110.444 173.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 143.07 -171.79 24.82 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.132 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.549 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.0 m -95.73 111.25 23.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.538 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -123.9 -176.39 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.905 -177.068 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.8 mt -81.12 131.56 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.863 0.363 . . . . 0.0 111.158 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 23' ' ' ARG . 12.8 tt0 -125.63 -58.95 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.572 173.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 7.5 tmtm? -87.65 125.97 34.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.389 -175.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -134.9 115.74 13.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.653 -172.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -112.59 1.2 15.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.747 -176.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.461 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 77.7 mt -90.77 154.75 19.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -175.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -85.94 43.21 1.03 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -119.84 143.07 34.34 Favored Pre-proline 0 C--N 1.315 -0.897 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.226 -175.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.48 142.49 72.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.485 2.123 . . . . 0.0 112.283 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -76.35 125.31 87.81 Favored Pre-proline 0 N--CA 1.447 -0.609 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.532 ' HG3' ' CH2' ' A' ' 49' ' ' TRP . 33.9 Cg_endo -63.92 158.56 46.59 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 123.143 2.562 . . . . 0.0 112.386 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.432 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 60.5 p -81.62 169.73 16.69 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.454 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -60.34 -43.77 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.65 71.48 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -61.38 -45.25 95.16 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.768 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.493 HD22 HD11 ' A' ' 3' ' ' LEU . 88.1 mt -52.79 -48.8 66.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.594 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.21 -30.36 68.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.776 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.4 m -66.54 -38.14 86.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.417 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.532 ' CH2' ' HG3' ' A' ' 41' ' ' PRO . 46.4 m0 -56.42 -51.39 68.57 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.059 0.457 . . . . 0.0 109.855 175.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -59.21 -46.63 87.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.609 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.02 -46.45 90.7 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.673 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.34 -39.22 93.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.914 0.388 . . . . 0.0 110.815 178.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 5' ' ' ASP . 52.0 tp -64.79 -44.09 91.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.16 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -73.94 -32.8 63.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.0 -177.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.6 tttm -90.29 -3.37 57.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.729 0.3 . . . . 0.0 111.787 -173.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -114.48 148.79 41.02 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.817 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.499 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 18.7 Cg_endo -61.18 132.82 43.41 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.891 2.394 . . . . 0.0 112.634 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 38.1 Cg_exo -61.12 153.04 67.43 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 123.372 2.715 . . . . 0.0 112.76 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -66.07 126.6 29.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.364 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 . . . . . 0 C--O 1.235 0.318 0 O-C-N 123.631 0.582 . . . . 0.0 111.391 -177.327 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.855 0.359 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.65 120.39 64.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.56 -0.534 . . . . 0.0 109.56 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.531 HD11 HD22 ' A' ' 46' ' ' LEU . 2.4 mm? -70.38 -34.02 72.09 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.1 -47.43 65.26 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.416 0.447 . . . . 0.0 110.925 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.415 ' HB2' ' HZ3' ' A' ' 50' ' ' TRP . 4.5 m-20 -67.81 -48.06 67.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.155 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.15 78.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.737 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 84.2 mt -62.38 -45.53 98.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.73 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.1 ttm -73.98 -24.41 59.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.294 -175.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -65.45 -43.0 91.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 174.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -79.38 -44.3 21.77 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.571 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -122.6 92.85 48.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.354 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.18 -24.24 38.44 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.905 2.404 . . . . 0.0 112.637 -177.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -94.27 10.1 35.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.603 0.716 . . . . 0.0 110.359 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.431 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -80.51 95.36 6.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.455 174.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.2 t -77.92 110.31 13.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.48 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 18.3 m -64.99 153.55 40.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.988 176.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 17' ' ' ARG . 58.8 mtt180 75.33 -33.9 0.24 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.558 0.743 . . . . 0.0 111.004 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 16' ' ' SER . 42.4 tptt -80.02 -59.99 2.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.133 0.492 . . . . 0.0 110.255 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.603 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 11.7 t70 -100.25 -48.03 4.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.205 -176.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.431 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 29.8 p90 -131.08 143.83 50.97 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.198 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.433 ' H ' ' HB3' ' A' ' 33' ' ' LYS . 45.5 tt0 -129.86 132.99 46.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.44 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 36.2 mt -99.91 154.23 18.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.082 0.468 . . . . 0.0 111.38 -173.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.483 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -124.16 162.68 23.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.455 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -101.82 106.73 17.75 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.34 -40.95 22.77 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.3 -173.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.4 -58.6 0.16 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.539 -0.838 . . . . 0.0 112.417 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -94.2 -5.99 45.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.88 0.371 . . . . 0.0 111.225 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 176.53 179.56 47.02 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.048 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 10.4 p -105.7 132.45 51.82 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.452 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 52.6 p90 -146.13 -173.59 4.21 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.905 0.384 . . . . 0.0 111.458 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.44 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 23.6 mt -62.15 127.48 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.411 -170.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.483 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 10.2 tp10 -118.66 -58.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 172.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.26 126.95 43.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.12 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -139.7 111.58 7.39 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.95 -11.21 15.37 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.57 -0.452 . . . . 0.0 112.15 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.603 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 60.0 mt -55.3 133.36 49.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.149 0.5 . . . . 0.0 110.896 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 37' ' ' ARG . 54.9 mtt180 -80.12 61.05 3.84 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.532 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -146.38 141.4 16.32 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.497 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.01 137.16 75.73 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 123.068 2.512 . . . . 0.0 112.204 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.436 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 4.4 mm? -57.74 122.58 57.74 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.231 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 40' ' ' LEU . 18.5 Cg_endo -60.13 158.77 28.78 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.995 2.463 . . . . 0.0 112.234 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.587 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 27.5 p -99.81 162.69 12.84 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -51.79 -49.53 62.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.567 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.43 -46.82 83.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.028 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.97 -44.6 94.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.255 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 42' ' ' THR . 82.7 mt -58.47 -46.16 87.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.476 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.81 -34.85 76.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.755 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.415 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 58.8 m -62.57 -42.93 99.85 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.852 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.401 ' CH2' ' HB3' ' A' ' 41' ' ' PRO . 41.0 m0 -65.8 -37.11 85.38 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.952 0.406 . . . . 0.0 110.323 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.415 ' HZ3' ' HB2' ' A' ' 5' ' ' ASP . 68.6 t-105 -62.65 -45.51 92.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.005 174.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.54 -36.84 85.0 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.691 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 48' ' ' THR . 43.3 mt-10 -59.6 -46.53 88.69 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.126 174.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.13 -47.3 85.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.949 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -64.82 -28.31 69.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.227 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -95.56 2.51 54.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.99 0.424 . . . . 0.0 110.798 -178.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.465 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 43.1 t-20 -90.25 125.69 59.29 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.465 ' HD2' ' HA ' ' A' ' 56' ' ' ASN . 6.5 Cg_endo -49.39 145.91 15.04 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.425 2.75 . . . . 0.0 112.792 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -47.77 140.84 17.02 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.708 2.939 . . . . 0.0 113.161 -177.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -77.46 116.84 18.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.649 -176.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.8 177.789 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.863 0.363 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.69 HG23 ' HB2' ' A' ' 29' ' ' SER . 2.9 mp -90.86 122.79 42.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.014 0.435 . . . . 0.0 110.253 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.438 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.2 mm? -61.83 -30.87 71.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.129 -176.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -51.23 -45.73 62.03 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.173 -177.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -63.45 -49.58 73.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.987 0.423 . . . . 0.0 111.191 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.405 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -59.98 -46.25 90.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.515 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -63.34 -41.77 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.15 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.436 ' HA ' ' CE ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -64.37 -29.0 70.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.944 -178.207 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -76.02 -38.17 57.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.804 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.476 ' HD3' ' CE2' ' A' ' 49' ' ' TRP . 42.8 tptt -76.17 -45.46 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.81 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -126.47 83.94 63.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.218 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.58 -21.39 46.02 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.735 2.29 . . . . 0.0 112.091 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.14 4.72 47.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.638 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -98.9 138.24 36.3 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -96.83 121.74 47.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-O 120.981 0.42 . . . . 0.0 111.018 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 138.62 58.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.689 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 69.0 13.73 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.615 0.572 . . . . 0.0 111.316 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HG3' ' OD1' ' A' ' 19' ' ' ASP . 24.2 tptp -116.26 -72.82 0.67 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.405 177.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.495 ' OD1' ' HG3' ' A' ' 18' ' ' LYS . 3.0 m-20 -101.77 -1.05 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.301 0.572 . . . . 0.0 110.924 -179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -148.2 124.03 10.59 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 169.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.896 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 34.2 tt0 -110.65 126.57 54.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.126 -176.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.569 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 29.8 mt -103.75 152.86 21.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.996 -173.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.569 ' HD2' ' O ' ' A' ' 22' ' ' LEU . 2.3 mpt_? -133.94 174.59 10.31 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.502 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -89.46 122.17 32.4 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.178 178.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.27 -38.77 26.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.356 0.598 . . . . 0.0 110.206 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.49 -56.99 0.47 Allowed Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.866 -176.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -97.8 -11.0 23.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.557 0.694 . . . . 0.0 109.903 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -168.23 -166.53 27.45 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.71 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.69 ' HB2' HG23 ' A' ' 2' ' ' ILE . 42.3 m -102.39 141.83 34.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.647 0.224 . . . . 0.0 110.514 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.54 177.99 7.39 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 45.1 mt -84.66 131.43 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.624 -177.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.46 -55.24 2.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.164 0.507 . . . . 0.0 109.812 174.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.896 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 4.8 ttmp? -109.91 110.18 21.05 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.382 -176.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -105.33 112.81 26.06 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -118.06 6.06 12.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.184 0.516 . . . . 0.0 110.565 -174.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 57.4 mt -81.28 149.23 29.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.9 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -83.13 40.08 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.362 0.601 . . . . 0.0 110.7 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -128.7 152.78 79.3 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.642 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.33 156.06 67.02 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.317 2.012 . . . . 0.0 111.994 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.3 mm? -71.91 125.32 91.61 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.417 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 23.8 Cg_endo -61.71 159.38 33.07 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.99 2.46 . . . . 0.0 112.599 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.598 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 61.7 p -94.64 156.14 16.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.28 -178.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.0 tm0? -52.41 -45.27 65.82 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.71 0.631 . . . . 0.0 109.832 177.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.2 -51.77 68.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.608 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -64.7 -34.71 78.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.132 -177.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 42' ' ' THR . 93.4 mt -54.34 -46.54 72.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.88 -26.65 59.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.2 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.8 m -63.89 -46.99 82.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.264 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.476 ' CE2' ' HD3' ' A' ' 10' ' ' LYS . 13.6 m0 -63.78 -35.45 80.65 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.08 0.467 . . . . 0.0 109.782 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -60.96 -49.22 78.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.595 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -64.11 -38.83 92.47 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.666 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.66 -48.82 77.67 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.914 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.9 tp -60.54 -22.22 63.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.128 0.49 . . . . 0.0 110.833 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.78 -46.14 10.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.231 178.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.84 -17.08 42.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -119.37 109.54 38.52 Favored Pre-proline 0 C--N 1.311 -1.098 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.844 -173.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.504 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 71.8 Cg_endo -77.49 140.7 19.35 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.689 2.259 . . . . 0.0 112.38 178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.504 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 13.0 Cg_exo -70.29 152.76 66.74 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.914 2.41 . . . . 0.0 112.045 177.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -70.33 113.6 7.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.993 0.425 . . . . 0.0 110.213 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 . . . . . 0 C--N 1.323 -0.545 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.244 -179.436 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 ppp? . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.5 mp -112.88 128.77 69.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.13 -179.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 7' ' ' ILE . 3.7 mm? -67.59 -40.52 84.79 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.791 0.329 . . . . 0.0 111.376 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.523 ' CD1' HD11 ' A' ' 22' ' ' LEU . 40.4 t80 -52.62 -47.29 67.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.995 -176.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.53 -44.61 93.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.534 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.519 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -64.58 -45.82 85.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.787 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 3' ' ' LEU . 70.6 mt -58.86 -48.26 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.69 178.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -26.38 68.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.846 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -69.2 -49.69 54.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.321 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.654 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 86.1 tttt -77.8 -35.76 51.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.996 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -117.8 79.84 13.6 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.852 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.445 ' HD3' ' O ' ' A' ' 10' ' ' LYS . 3.4 Cg_exo -78.38 -23.3 8.81 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.964 2.443 . . . . 0.0 112.066 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -85.19 -6.48 59.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.76 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.4 127.93 34.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.521 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.8 t -82.7 121.13 35.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.093 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.3 t -69.0 143.25 54.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.191 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HA ' ' HG2' ' A' ' 21' ' ' GLU . 81.5 mtt180 63.14 21.43 12.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.964 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -109.29 -69.64 0.85 Allowed 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.418 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -99.43 -46.21 5.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.468 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 32.8 p90 -100.68 138.16 38.12 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 175.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.463 ' CB ' ' HB3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -131.1 142.53 50.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.041 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.523 HD11 ' CD1' ' A' ' 4' ' ' TYR . 14.0 mt -101.71 144.81 29.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.842 -172.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -143.43 169.37 17.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.552 176.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 29' ' ' SER . 10.6 t30 -106.09 112.28 25.26 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.609 -176.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.591 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 30.8 t70 -79.64 -28.37 40.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.803 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 175.84 -95.44 0.1 Allowed Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.484 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -95.91 35.29 1.42 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.483 0.658 . . . . 0.0 109.789 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.77 148.9 7.12 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.97 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 24' ' ' ASN . 16.9 m -99.17 129.05 45.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 178.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.591 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -134.78 -168.68 2.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.946 0.403 . . . . 0.0 110.971 -173.114 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -81.96 132.69 30.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.174 177.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -125.23 -53.67 1.61 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 20' ' ' PHE . 58.2 tttm -94.55 122.91 37.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.875 178.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -136.47 111.01 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -118.15 3.71 12.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.249 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.7 mt -71.86 137.62 47.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -79.81 59.58 3.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.87 0.843 . . . . 0.0 110.238 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -139.76 150.58 63.4 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.136 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.57 147.85 46.59 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.187 1.925 . . . . 0.0 111.898 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.11 130.87 93.19 Favored Pre-proline 0 N--CA 1.449 -0.49 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.03 176.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.468 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 41.8 Cg_endo -68.19 168.61 18.75 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.848 2.365 . . . . 0.0 112.994 -177.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 41.1 p -104.33 165.29 11.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.546 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -57.36 -43.77 83.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.291 0.567 . . . . 0.0 109.735 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.79 -47.82 73.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.97 -1.014 . . . . 0.0 110.633 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.434 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 30.4 mt-10 -58.24 -53.42 58.48 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 176.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.8 mt -52.31 -49.09 64.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.627 -177.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.72 -33.45 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.627 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 91.8 m -64.08 -45.28 89.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.554 0.216 . . . . 0.0 110.556 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.654 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.0 m0 -63.72 -42.13 97.98 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -63.1 -44.31 96.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.801 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -62.29 -46.73 87.44 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.497 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.547 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 45.5 mt-10 -64.0 -37.35 87.1 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.861 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.9 tp -65.09 -30.03 70.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.869 0.366 . . . . 0.0 110.914 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -91.39 -39.76 11.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.091 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -88.4 -15.8 34.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.162 0.506 . . . . 0.0 111.447 -173.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.547 ' HB3' ' O ' ' A' ' 52' ' ' GLU . 9.0 t30 -110.68 122.75 37.4 Favored Pre-proline 0 C--N 1.315 -0.929 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.533 176.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 56' ' ' ASN . 11.5 Cg_exo -70.78 117.25 5.04 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.865 2.377 . . . . 0.0 112.536 -177.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 3.6 Cg_exo -75.91 138.32 20.79 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.777 2.318 . . . . 0.0 110.964 175.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -88.25 121.83 31.1 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.86 0.362 . . . . 0.0 110.62 -176.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.702 177.998 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 ttt . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.471 ' N ' HD12 ' A' ' 2' ' ' ILE . 3.9 mp -87.13 112.62 23.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.457 HD11 HD13 ' A' ' 46' ' ' LEU . 2.9 mm? -70.13 -34.36 72.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.113 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -51.17 -49.18 61.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.861 -175.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.25 -51.09 70.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.339 -177.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.72 90.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.461 -177.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 3' ' ' LEU . 77.8 mt -63.25 -47.86 90.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.249 -178.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.4 ttm -76.25 -16.99 59.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.969 0.414 . . . . 0.0 111.012 -174.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.438 ' CD2' ' HB3' ' A' ' 49' ' ' TRP . 92.4 t80 -69.38 -44.72 70.9 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 174.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -82.07 -37.21 26.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.092 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -124.17 97.74 39.91 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 121.069 0.462 . . . . 0.0 111.226 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -66.53 -27.81 45.93 Favored 'Trans proline' 0 CA--C 1.528 0.185 0 C-N-CA 122.857 2.371 . . . . 0.0 112.567 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -87.34 8.82 22.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.667 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.528 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -78.71 107.06 11.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.895 0.379 . . . . 0.0 110.526 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.67 105.83 15.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.406 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m -70.03 140.97 52.94 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.441 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 71.38 12.4 6.65 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.577 177.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -116.38 -76.48 0.57 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -91.5 -31.24 16.03 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.147 0.499 . . . . 0.0 110.415 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.528 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 17.2 p90 -127.62 135.67 50.58 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 170.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -130.51 139.96 50.5 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.464 0.649 . . . . 0.0 110.557 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.0 mt -93.61 146.86 23.51 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.493 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.428 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.9 mpt_? -130.92 169.8 15.31 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 176.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -92.3 117.86 30.32 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.441 -175.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -86.82 -26.24 24.16 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 132.18 -38.31 1.91 Allowed Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.03 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -87.44 -22.34 25.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.355 0.598 . . . . 0.0 110.427 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 171.02 -160.24 32.58 Favored Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.351 177.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 m -99.24 112.3 24.49 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -116.9 173.63 6.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.442 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.6 mt -69.96 114.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.248 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.428 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 1.6 tm-20 -121.1 -53.62 2.04 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.678 ' HA ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -98.82 116.91 32.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -129.36 111.86 13.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -114.55 3.88 15.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.921 0.391 . . . . 0.0 110.813 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.8 mt -70.66 145.58 50.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.89 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -81.79 49.03 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.144 0.497 . . . . 0.0 110.396 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . . . -146.17 140.05 15.11 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.808 -176.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 38' ' ' ALA . 38.6 Cg_exo -61.92 148.25 93.52 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.075 2.517 . . . . 0.0 112.59 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.08 142.95 90.82 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.296 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.19 171.72 16.27 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.387 2.058 . . . . 0.0 110.963 170.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.7 p -104.6 167.77 9.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.49 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -56.61 -47.95 78.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.136 0.493 . . . . 0.0 110.021 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.11 -48.88 73.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.172 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -57.39 -49.73 75.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.303 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.457 HD13 HD11 ' A' ' 3' ' ' LEU . 91.7 mt -55.59 -47.74 76.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.046 0.45 . . . . 0.0 111.184 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -75.9 -18.0 59.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.635 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.3 m -64.92 -50.08 67.88 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.438 ' HB3' ' CD2' ' A' ' 9' ' ' TYR . 8.1 m0 -67.26 -31.74 72.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.22 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -62.09 -44.77 95.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.927 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -60.8 -46.19 91.49 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.842 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.39 -35.8 81.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.915 0.388 . . . . 0.0 111.0 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.3 tp -65.42 -38.84 91.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.667 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.71 -25.37 41.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.127 0.489 . . . . 0.0 110.435 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.444 ' O ' ' HB3' ' A' ' 56' ' ' ASN . 43.2 tttm -87.16 18.92 3.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.244 178.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 55' ' ' LYS . 11.5 t30 78.29 107.78 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.386 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.408 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.49 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 40.1 Cg_endo -68.31 128.63 17.72 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.939 2.426 . . . . 0.0 112.171 179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 9.4 Cg_exo -71.2 168.1 24.31 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.936 2.424 . . . . 0.0 112.482 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -108.35 133.34 52.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.703 177.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 . . . . . 0 C--N 1.326 -0.439 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.152 -179.114 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.4 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.421 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.4 mp -104.87 115.31 46.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.512 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.2 OUTLIER -63.44 -32.76 74.29 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.096 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.402 ' HE1' ' HB3' ' A' ' 16' ' ' SER . 22.8 t80 -52.98 -48.57 67.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.084 -176.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.6 -48.8 79.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.351 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.69 -43.78 85.34 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.432 178.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.7 mt -67.09 -38.31 80.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.54 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.0 mmt -68.64 -22.5 64.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.481 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -79.25 -38.31 35.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.848 0.356 . . . . 0.0 110.309 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? -80.68 -50.78 9.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.96 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -118.81 85.33 27.79 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.992 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.64 -20.85 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.624 2.216 . . . . 0.0 112.879 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -90.1 -8.34 51.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.073 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.14 141.93 58.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.327 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.448 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 33.4 t -104.12 128.44 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.14 0.495 . . . . 0.0 110.738 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.402 ' HB3' ' HE1' ' A' ' 4' ' ' TYR . 3.0 p -70.67 141.81 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.321 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 43.2 mtt180 65.55 25.12 11.77 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.513 0.673 . . . . 0.0 110.705 -176.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 84.8 tttt -140.92 -60.16 0.5 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.382 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.401 ' HB3' HD21 ' A' ' 36' ' ' LEU . 33.8 m-20 -86.98 -38.36 16.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.865 176.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 p90 -152.26 149.37 28.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.043 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 66.7 tt0 -136.02 135.39 39.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.466 ' CD2' ' HA ' ' A' ' 31' ' ' ILE . 48.9 mt -117.24 155.19 29.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.863 0.363 . . . . 0.0 111.627 -170.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 29' ' ' SER . 5.6 mpt_? -124.22 173.73 8.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.017 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -98.43 119.55 37.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.655 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -81.1 -33.08 33.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.226 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.96 -36.25 3.51 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -170.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -95.33 9.41 39.97 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 173.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 134.27 -176.7 19.68 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.789 -178.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.454 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 11.1 m -84.67 130.57 34.69 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -120.42 171.43 8.54 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.784 0.326 . . . . 0.0 110.606 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.512 HG13 ' HG ' ' A' ' 3' ' ' LEU . 62.7 mt -82.33 121.77 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.23 -176.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -108.75 -58.41 2.01 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 176.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 32.0 mmtp -99.17 131.74 44.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.516 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -133.58 111.62 10.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 175.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -114.18 1.29 14.5 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.081 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.401 HD21 ' HB3' ' A' ' 19' ' ' ASP . 76.8 mt -78.73 147.71 33.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 -177.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.7 mtp180 -87.5 36.06 0.74 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.432 177.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.23 141.1 38.81 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.006 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.79 148.73 93.05 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.826 2.35 . . . . 0.0 112.459 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.91 128.59 93.37 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.661 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.43 ' HG2' HD21 ' A' ' 46' ' ' LEU . 56.1 Cg_endo -71.23 171.67 15.57 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.546 2.164 . . . . 0.0 111.909 176.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.475 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.9 p -93.6 165.29 12.8 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.702 -177.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -59.22 -39.66 83.37 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.168 178.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.92 95.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.314 176.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.55 -48.48 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.879 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 42' ' ' THR . 99.7 mt -55.35 -47.2 76.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.336 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.39 -28.28 66.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.0 m -62.94 -50.76 69.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.565 0.222 . . . . 0.0 110.807 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -65.1 -38.56 91.1 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-O 120.974 0.416 . . . . 0.0 110.276 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -58.76 -49.26 78.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.714 177.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.86 -44.51 96.91 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 123.141 0.576 . . . . 0.0 111.765 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.488 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.26 -38.08 82.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.903 0.382 . . . . 0.0 110.474 177.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -69.65 -38.87 77.3 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.544 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -79.65 -13.18 59.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.898 0.38 . . . . 0.0 111.884 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 57' ' ' PRO . 84.2 m-20 -97.36 155.56 37.21 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-O 120.918 0.389 . . . . 0.0 111.721 -175.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 56' ' ' ASN . 3.8 Cg_exo -77.18 164.46 29.25 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.383 2.722 . . . . 0.0 111.603 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -67.67 146.65 73.94 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.574 2.183 . . . . 0.0 112.291 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -84.25 146.46 27.77 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 . . . . . 0 C--N 1.325 -0.474 0 O-C-N 123.229 0.33 . . . . 0.0 111.531 -178.53 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.0 mp -104.43 111.1 32.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.929 0.395 . . . . 0.0 110.151 178.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.732 ' HG ' HG13 ' A' ' 31' ' ' ILE . 2.8 mm? -70.04 -30.59 67.91 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.4 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -50.45 -40.4 50.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.79 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.401 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 23.7 m-20 -67.56 -55.3 14.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.61 -177.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.87 86.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.57 -176.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.0 mt -64.06 -44.86 97.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.268 -177.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 69.9 mtp -81.88 -9.04 59.71 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.485 -176.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -77.39 -38.9 48.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.64 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 61.9 tttm -81.35 -38.19 27.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.239 177.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.53 ' HB2' ' HB2' ' A' ' 14' ' ' ALA . 85.1 m-85 -121.08 98.58 47.16 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.536 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.77 -24.49 68.64 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.609 2.206 . . . . 0.0 111.973 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -98.53 17.86 18.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.043 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.53 ' HB2' ' HB2' ' A' ' 11' ' ' TYR . . . -86.76 101.41 13.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.141 0.496 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 37.7 t -88.79 117.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.449 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 p -72.04 150.6 43.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.468 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 64.88 23.05 12.59 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -125.05 -72.06 0.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.037 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.7 t0 -109.25 4.83 23.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.786 0.803 . . . . 0.0 110.022 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.495 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 39.6 p90 -165.27 127.18 2.07 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 171.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -113.33 130.42 56.27 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.126 0.489 . . . . 0.0 111.169 -172.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.34 153.2 24.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.667 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.508 ' NH1' ' HG2' ' A' ' 32' ' ' GLU . 3.9 mpt_? -133.32 173.96 10.91 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.246 0.546 . . . . 0.0 111.208 176.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -99.52 123.62 43.96 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.204 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.434 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 7.1 t70 -98.19 -34.64 10.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.224 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.74 -29.14 5.94 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -174.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -100.36 -8.93 22.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.611 0.72 . . . . 0.0 109.588 175.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.8 177.42 30.89 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.776 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.2 m -96.13 115.48 27.5 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.434 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 53.5 p90 -106.17 171.24 7.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.806 -172.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.732 HG13 ' HG ' ' A' ' 3' ' ' LEU . 58.5 mt -87.45 118.71 33.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.977 176.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.508 ' HG2' ' NH1' ' A' ' 23' ' ' ARG . 8.9 tp10 -101.97 -56.55 2.25 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.78 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -121.29 113.09 19.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.336 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.442 ' CH2' HD12 ' A' ' 36' ' ' LEU . 58.1 t-105 -106.83 112.53 25.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.173 -174.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 6.1 m-20 -110.86 1.94 17.94 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -177.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.442 HD12 ' CH2' ' A' ' 34' ' ' TRP . 90.7 mt -69.57 141.42 53.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.32 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -82.59 41.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.489 0.661 . . . . 0.0 110.748 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.13 142.17 40.84 Favored Pre-proline 0 C--N 1.315 -0.935 0 CA-C-N 115.104 -0.953 . . . . 0.0 108.774 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.4 155.74 50.54 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.381 2.054 . . . . 0.0 111.962 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.4 mm? -65.8 120.55 69.75 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.598 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -62.69 168.83 9.47 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.918 2.412 . . . . 0.0 112.117 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.4 p -94.1 167.03 11.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.74 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -62.57 -44.19 96.93 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.898 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.79 -45.05 86.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.208 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -57.7 -54.11 50.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.818 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.451 ' HA ' ' CE3' ' A' ' 49' ' ' TRP . 93.3 mt -55.21 -46.21 75.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.826 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.77 -20.77 59.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -177.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 88.5 m -70.83 -44.35 66.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.107 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.64 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 9.5 m0 -64.31 -36.97 85.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.424 ' O ' ' HB2' ' A' ' 54' ' ' GLN . 62.0 t-105 -60.97 -42.75 98.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.312 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -70.51 -43.39 69.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.23 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -61.8 -40.78 96.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.401 ' CD2' ' HB3' ' A' ' 5' ' ' ASP . 58.5 tp -68.38 -34.35 75.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.525 176.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' A' ' 50' ' ' TRP . 0.4 OUTLIER -72.61 -25.17 61.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.063 0.458 . . . . 0.0 110.541 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 74.5 tttt -78.65 -6.76 56.55 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.506 175.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.3 t30 71.52 109.2 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.313 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.284 -174.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.68 144.61 99.4 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.048 2.498 . . . . 0.0 112.888 -177.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.27 -177.88 1.91 Allowed 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.048 2.499 . . . . 0.0 112.401 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -60.42 120.04 9.14 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.893 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.002 -179.891 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.429 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 1.3 tmt? . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.423 HG22 ' H ' ' A' ' 4' ' ' TYR . 4.4 mp -106.28 124.52 61.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.267 -177.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.626 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 0.2 OUTLIER -65.86 -32.98 74.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.515 179.435 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.456 ' HE1' ' OG ' ' A' ' 16' ' ' SER . 81.8 t80 -52.17 -47.63 65.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.258 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.455 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 0.9 OUTLIER -60.4 -47.81 84.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.401 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.89 99.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.12 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 3' ' ' LEU . 82.1 mt -63.49 -43.25 98.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.15 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 30.6 mmt -67.71 -23.29 65.26 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.165 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -81.39 -37.7 27.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.938 0.399 . . . . 0.0 110.437 177.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -82.78 -50.81 8.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.382 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -132.33 88.02 41.13 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.467 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -68.35 -13.12 36.89 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.744 2.296 . . . . 0.0 111.3 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -75.93 -13.74 60.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.875 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.9 137.63 32.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.549 ' HB ' ' HD3' ' A' ' 18' ' ' LYS . 47.7 t -99.34 129.36 49.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.89 0.376 . . . . 0.0 110.743 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.456 ' OG ' ' HE1' ' A' ' 4' ' ' TYR . 14.9 m -62.92 134.4 56.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.253 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 70.8 3.98 4.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.533 0.733 . . . . 0.0 111.553 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.549 ' HD3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -110.96 -63.84 1.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.851 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.544 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 52.5 m-20 -90.0 -17.71 27.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.288 -177.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.2 p90 -153.51 130.35 10.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.517 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 33.2 tt0 -109.79 126.39 53.72 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 mt -90.77 150.85 21.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.612 0.72 . . . . 0.0 111.542 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -139.68 154.75 47.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.502 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -86.3 123.7 31.84 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.057 0.456 . . . . 0.0 110.783 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.468 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 1.7 t70 -88.86 -32.69 17.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.325 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 120.07 -43.61 1.52 Allowed Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -79.5 -20.03 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.451 0.644 . . . . 0.0 109.579 173.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.429 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 163.72 -172.07 39.52 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.317 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -88.19 121.66 30.84 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.626 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.3 p90 -117.94 -178.06 3.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.447 -0.205 . . . . 0.0 110.447 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.441 HD11 HD11 ' A' ' 7' ' ' ILE . 31.0 mt -91.11 121.6 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.972 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -98.65 -53.33 3.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.517 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 2.8 tppp? -94.76 104.52 16.43 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.351 178.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 61.5 t-105 -87.03 108.89 19.06 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 168.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -106.91 -2.97 20.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.463 0.649 . . . . 0.0 110.41 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.544 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 73.2 mt -86.95 147.62 25.68 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.873 175.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.2 mtp180 -92.57 36.2 1.01 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.474 ' HB1' ' HD2' ' A' ' 39' ' ' PRO . . . -111.2 161.74 23.83 Favored Pre-proline 0 C--N 1.319 -0.723 0 CA-C-N 114.41 -1.268 . . . . 0.0 109.943 -177.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' 38' ' ' ALA . 30.8 Cg_endo -64.39 150.05 88.97 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.642 2.228 . . . . 0.0 112.468 178.389 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.58 134.08 51.64 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.898 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.412 ' HB3' ' CH2' ' A' ' 49' ' ' TRP . 43.0 Cg_endo -68.97 164.37 33.98 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.487 2.125 . . . . 0.0 111.375 172.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.604 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 70.3 p -95.87 167.63 11.13 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.704 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.519 HE21 ' HG3' ' A' ' 47' ' ' GLU . 23.2 tp60 -55.88 -46.81 78.22 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.343 0.592 . . . . 0.0 109.534 173.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.75 70.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.847 176.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.01 -46.62 87.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.415 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 42' ' ' THR . 87.4 mt -57.08 -44.52 83.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.909 0.385 . . . . 0.0 111.023 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.519 ' HG3' HE21 ' A' ' 43' ' ' GLN . 48.6 mt-10 -75.02 -24.64 58.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.056 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.8 m -73.07 -41.43 64.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.398 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.412 ' CH2' ' HB3' ' A' ' 41' ' ' PRO . 51.2 m0 -66.58 -31.98 73.03 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -64.46 -36.11 83.1 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.944 174.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.11 -50.25 49.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.295 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -62.22 -32.79 73.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.694 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.455 ' CD2' ' HB3' ' A' ' 5' ' ' ASP . 44.9 tp -61.11 -43.06 99.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.036 176.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -76.65 -31.62 57.45 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.491 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -74.01 -15.17 61.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.892 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -148.35 80.19 8.6 Favored Pre-proline 0 C--N 1.317 -0.811 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.3 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -71.94 161.89 43.54 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.924 2.416 . . . . 0.0 112.799 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -53.51 149.02 32.32 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 122.885 2.39 . . . . 0.0 111.854 176.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -64.86 125.25 24.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.177 0.513 . . . . 0.0 111.214 -173.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 . . . . . 0 C--N 1.323 -0.578 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.008 178.981 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.456 ' O ' ' HA3' ' A' ' 28' ' ' GLY . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.601 HG23 ' HB2' ' A' ' 29' ' ' SER . 4.2 mp -108.47 128.86 63.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.208 -177.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.45 ' HG ' HG13 ' A' ' 31' ' ' ILE . 0.6 OUTLIER -66.12 -32.55 74.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.399 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.508 ' H ' HG22 ' A' ' 2' ' ' ILE . 84.3 t80 -52.39 -45.56 65.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.685 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.36 -49.94 75.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 0.0 111.201 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.32 -45.08 95.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.295 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.29 -47.08 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.888 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.26 -29.64 70.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.83 -177.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -68.23 -45.34 73.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.048 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 10' ' ' LYS . 21.9 tptm -81.17 -35.8 30.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.887 -178.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -121.72 89.03 47.51 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.554 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -66.39 -22.01 53.05 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.983 2.455 . . . . 0.0 112.336 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -102.8 23.99 11.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.235 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.53 106.28 18.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.596 HG11 ' HD2' ' A' ' 18' ' ' LYS . 19.5 t -76.47 113.59 15.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.153 0.502 . . . . 0.0 111.201 -175.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.3 p -66.81 139.01 57.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.742 -178.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 68.8 6.93 5.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.448 -0.797 . . . . 0.0 112.099 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.596 ' HD2' HG11 ' A' ' 15' ' ' VAL . 50.1 mttp -119.18 -55.49 2.15 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.842 0.353 . . . . 0.0 110.265 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.455 ' OD1' ' HG ' ' A' ' 36' ' ' LEU . 10.7 t70 -91.66 -50.32 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.95 178.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -120.27 141.08 50.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.646 176.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.647 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 80.4 tt0 -129.51 131.09 46.55 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -177.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 mt -112.53 153.54 27.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.796 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.416 ' HD3' ' HA ' ' A' ' 23' ' ' ARG . 9.7 tpp180 -123.12 157.01 33.83 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.421 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -98.97 132.09 44.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.085 0.469 . . . . 0.0 111.357 -171.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -90.97 -48.3 7.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.689 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.55 -47.37 0.93 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -173.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -92.4 6.19 47.92 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.654 0.74 . . . . 0.0 109.695 174.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.456 ' HA3' ' O ' ' A' ' 1' ' ' MET . . . 161.93 -164.92 35.59 Favored Glycine 0 N--CA 1.441 -0.977 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.674 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.601 ' HB2' HG23 ' A' ' 2' ' ' ILE . 18.4 m -130.16 136.34 49.17 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 46.4 p90 -120.6 173.1 7.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.986 -173.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.45 HG13 ' HG ' ' A' ' 3' ' ' LEU . 29.7 mt -95.78 137.25 24.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.507 -175.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -129.46 -22.96 2.98 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.831 0.348 . . . . 0.0 111.184 167.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.647 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 20.7 mmtp -117.15 135.7 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.417 177.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.9 t-105 -154.43 111.67 3.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -110.39 -9.97 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.783 179.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.455 ' HG ' ' OD1' ' A' ' 19' ' ' ASP . 69.5 mt -56.62 133.27 53.59 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.174 0.512 . . . . 0.0 111.372 -178.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -80.84 51.44 1.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.384 -178.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.18 144.42 31.52 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.159 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.29 148.06 93.9 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.725 2.283 . . . . 0.0 112.3 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.2 mm? -65.28 133.77 95.6 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.944 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.63 169.21 21.59 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.974 2.449 . . . . 0.0 112.201 178.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.527 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 23.4 p -99.96 166.83 10.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -62.89 -39.03 93.25 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.53 91.14 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.423 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.88 -44.53 96.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.884 177.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 42' ' ' THR . 98.6 mt -59.74 -44.25 93.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.849 178.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 43' ' ' GLN . 53.3 mt-10 -60.94 -40.21 92.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.008 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.401 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 7.9 m -64.82 -48.12 75.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.47 -177.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -62.8 -35.03 78.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.152 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.521 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -61.5 -53.26 58.79 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.83 -43.53 90.71 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 48' ' ' THR . 42.4 mt-10 -58.77 -46.62 87.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.883 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 55.4 tp -62.27 -31.85 72.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.213 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.6 mm-40 -79.98 -39.19 30.61 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.502 -178.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -84.29 -16.91 41.37 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -95.82 154.87 38.95 Favored Pre-proline 0 C--N 1.311 -1.09 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.695 -179.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.06 126.76 21.13 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.475 2.117 . . . . 0.0 111.183 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.12 169.17 9.61 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.677 2.252 . . . . 0.0 112.907 -176.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -57.72 117.03 3.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.486 -178.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.376 -179.742 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.484 1.264 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.4 mp -106.34 106.4 20.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.994 0.426 . . . . 0.0 110.342 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.6 mm? -70.79 -32.67 69.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.41 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -51.37 -54.21 28.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.431 -175.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.404 ' HB2' ' HZ3' ' A' ' 50' ' ' TRP . 5.7 m-20 -63.89 -47.84 79.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.49 -179.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.51 -49.53 74.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -69.11 -42.05 81.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.122 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 tpt -63.74 -35.37 80.36 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.965 0.412 . . . . 0.0 110.816 -177.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -70.82 -43.66 68.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.129 178.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.427 ' HD2' ' CE2' ' A' ' 11' ' ' TYR . 6.3 tmtm? -70.72 -47.22 60.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.741 -176.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.427 ' CE2' ' HD2' ' A' ' 10' ' ' LYS . 80.3 m-85 -120.64 92.39 47.85 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.296 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -63.87 -27.56 67.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.463 2.109 . . . . 0.0 112.396 -178.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -94.27 12.75 25.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.424 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.88 122.35 33.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.192 0.52 . . . . 0.0 110.156 175.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -100.27 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.148 -176.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.43 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 9.2 p -84.07 39.96 0.73 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 122.003 0.906 . . . . 0.0 111.474 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.476 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 77.2 mtt180 -95.49 -72.59 0.62 Allowed 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.315 176.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.476 ' HD2' ' HB3' ' A' ' 17' ' ' ARG . 3.3 mptp? -114.66 -37.09 4.34 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.6 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.31 -44.15 88.45 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.825 0.822 . . . . 0.0 109.957 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.43 ' O ' ' HA ' ' A' ' 16' ' ' SER . 20.4 p90 -148.92 149.04 30.54 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 168.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -136.7 133.02 35.68 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.263 0.554 . . . . 0.0 110.958 -174.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.3 mt -94.85 153.92 17.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.116 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -135.22 154.21 51.66 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -178.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -75.24 123.74 25.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.548 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 11.7 t70 -87.35 -28.35 22.27 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.715 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.15 -43.56 1.69 Allowed Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 -173.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -100.31 10.67 40.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.977 0.894 . . . . 0.0 109.099 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 157.14 -160.55 30.53 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.779 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.507 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 19.3 m -130.92 121.51 25.31 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.548 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -125.74 -179.17 4.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.841 0.353 . . . . 0.0 110.924 -173.548 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.3 mt -84.04 118.99 32.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.144 0.497 . . . . 0.0 111.318 -175.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -90.14 -56.22 3.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.002 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -115.84 148.4 39.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.885 -178.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -150.44 111.39 4.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.267 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -120.05 7.38 10.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.044 0.45 . . . . 0.0 110.505 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.3 147.6 51.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -86.88 51.15 2.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.619 0.723 . . . . 0.0 109.983 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -135.32 146.33 57.51 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.302 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.45 136.61 77.06 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.865 2.377 . . . . 0.0 112.581 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.85 116.94 24.12 Favored Pre-proline 0 C--N 1.333 -0.138 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -60.47 151.0 78.09 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.672 2.248 . . . . 0.0 112.164 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.5 p -99.34 175.43 5.87 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.416 -178.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -53.79 -52.29 60.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.174 0.511 . . . . 0.0 110.759 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.63 -48.1 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -58.92 -49.94 75.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.496 HD22 HD11 ' A' ' 3' ' ' LEU . 80.2 mt -57.87 -49.11 77.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.207 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 42.4 mt-10 -69.15 -33.53 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.833 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -62.48 -41.9 99.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.682 0.277 . . . . 0.0 110.883 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -66.83 -35.2 79.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 110.257 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.404 ' HZ3' ' HB2' ' A' ' 5' ' ' ASP . 76.9 t-105 -66.66 -40.89 88.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.964 174.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 41.0 mt-10 -63.21 -43.9 96.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.264 177.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' A' ' 56' ' ' ASN . 39.0 mt-10 -62.33 -40.34 96.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.443 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 tp -65.94 -40.42 91.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.053 0.454 . . . . 0.0 110.454 176.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -66.0 -32.08 73.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.376 0.608 . . . . 0.0 110.615 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 55' ' ' LYS . 46.5 tttm -100.06 14.23 31.35 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.856 -178.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 52' ' ' GLU . 64.0 t30 -100.12 127.4 33.46 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 122.145 -0.347 . . . . 0.0 111.175 -177.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.467 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 24.6 Cg_exo -64.07 135.27 46.59 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.406 2.071 . . . . 0.0 110.106 167.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 31.7 Cg_exo -56.93 146.26 80.52 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.752 2.302 . . . . 0.0 113.361 -172.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -81.74 109.43 16.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.468 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.464 -177.366 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.6 mp -104.79 112.59 39.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.898 0.38 . . . . 0.0 110.434 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.51 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.6 mm? -70.41 -32.56 70.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.805 -178.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.499 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . 70.0 t80 -49.89 -52.42 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.74 -173.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.546 ' HB3' HD13 ' A' ' 53' ' ' LEU . 6.2 m-20 -66.76 -49.39 66.08 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.855 -177.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.23 -44.54 75.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.824 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 3' ' ' LEU . 73.2 mt -66.95 -48.83 78.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.694 -176.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.2 mtp -74.37 -22.26 59.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.161 -174.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -71.98 -37.81 69.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.093 0.473 . . . . 0.0 110.19 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -79.21 -48.92 13.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.993 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -116.14 101.17 53.94 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.914 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.41 -14.5 28.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.771 2.314 . . . . 0.0 112.369 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -94.13 4.97 53.15 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.219 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -100.69 117.73 35.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.757 0.313 . . . . 0.0 110.441 -177.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.565 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 45.3 t -95.77 129.29 46.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.832 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -68.15 139.49 56.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.0 mtt-85 66.54 6.06 4.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.59 -177.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.565 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 50.2 tttm -109.95 -64.95 1.2 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.487 ' HA ' ' HB2' ' A' ' 35' ' ' ASN . 46.2 m-20 -93.08 -25.64 17.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.913 -176.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.505 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 44.9 p90 -147.91 131.82 17.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.427 177.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.852 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 31.2 tt0 -120.06 134.97 55.1 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.499 ' CD1' ' HB2' ' A' ' 4' ' ' TYR . 35.9 mt -95.79 153.67 17.62 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.656 -170.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.0 162.8 34.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.648 175.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 -100.16 135.4 41.65 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 120.835 0.35 . . . . 0.0 110.647 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.422 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 12.9 t70 -99.39 -42.01 7.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.289 0.566 . . . . 0.0 109.996 175.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.45 -63.22 0.16 Allowed Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 -178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -112.0 17.4 19.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.584 0.706 . . . . 0.0 110.104 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -170.52 163.87 37.09 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.873 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.436 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 16.3 m -115.92 116.17 27.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' A' ' 25' ' ' ASP . 19.8 p90 -113.55 -175.96 2.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.587 -175.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 mt -89.96 126.48 42.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.799 0.333 . . . . 0.0 111.649 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -104.9 -56.17 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 172.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.852 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 17.3 mmtm -85.91 104.27 15.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.928 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.402 ' CH2' HD12 ' A' ' 36' ' ' LEU . 28.9 t-105 -101.95 112.34 24.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 174.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.487 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 30.8 m-80 -116.39 17.24 15.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.288 -175.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.402 HD12 ' CH2' ' A' ' 34' ' ' TRP . 87.9 mt -106.67 149.62 27.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.395 179.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -89.46 35.93 0.83 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.293 0.568 . . . . 0.0 110.064 177.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . . . -114.51 141.8 27.17 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.345 -176.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 38' ' ' ALA . 22.0 Cg_exo -64.57 141.92 75.43 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 123.109 2.539 . . . . 0.0 111.852 175.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 41' ' ' PRO . 4.0 mm? -66.75 138.37 95.34 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.583 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 40' ' ' LEU . 6.2 Cg_exo -77.39 -174.84 2.37 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.22 2.614 . . . . 0.0 112.248 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.471 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 82.1 p -105.04 170.86 7.63 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.442 -178.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.27 -48.08 81.49 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.144 0.278 . . . . 0.0 110.922 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.47 -44.09 72.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.04 -55.17 38.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.398 177.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 42' ' ' THR . 90.5 mt -56.41 -47.14 79.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.9 -29.54 67.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.089 -176.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 87.9 m -67.24 -44.2 80.02 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.376 178.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.437 ' CZ3' HD23 ' A' ' 46' ' ' LEU . 25.3 m0 -60.82 -45.17 95.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.157 0.503 . . . . 0.0 109.88 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.4 t-105 -59.27 -47.92 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.771 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.04 -41.46 95.19 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.167 -0.469 . . . . 0.0 112.243 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -60.12 -40.87 91.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.768 0.318 . . . . 0.0 110.713 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.546 HD13 ' HB3' ' A' ' 5' ' ' ASP . 9.9 tt -64.96 -42.19 94.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.778 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -69.01 -35.89 77.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.274 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -92.18 6.56 46.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.032 -175.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.403 ' OD1' ' HD2' ' A' ' 57' ' ' PRO . 54.3 t30 -93.32 129.76 37.92 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.824 178.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.403 ' HD2' ' OD1' ' A' ' 56' ' ' ASN . 77.1 Cg_exo -50.59 160.21 1.8 Allowed 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 123.157 2.571 . . . . 0.0 112.472 174.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.24 157.36 17.95 Favored 'Trans proline' 0 C--O 1.238 0.491 0 C-N-CA 123.147 2.564 . . . . 0.0 113.382 -175.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -82.16 143.15 31.63 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.995 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 . . . . . 0 C--O 1.238 0.453 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.604 178.259 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.4 HG22 ' HB3' ' A' ' 4' ' ' TYR . 3.1 mp -113.44 116.71 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.13 -32.35 73.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.926 0.393 . . . . 0.0 110.823 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.4 ' HB3' HG22 ' A' ' 2' ' ' ILE . 87.8 t80 -52.27 -48.42 65.3 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.1 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -61.63 -51.27 69.18 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.524 -178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.92 -46.35 88.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.569 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.407 HG21 ' CZ ' ' A' ' 20' ' ' PHE . 84.4 mt -67.65 -46.26 83.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.966 -178.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.478 ' HA ' ' HE2' ' A' ' 8' ' ' MET . 0.0 OUTLIER -66.03 -31.66 72.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.005 0.431 . . . . 0.0 110.694 -176.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.429 ' OH ' ' HB3' ' A' ' 52' ' ' GLU . 13.5 t80 -63.76 -51.64 63.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.112 177.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.4 tttp -81.75 -43.11 18.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.616 -174.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -123.03 94.08 47.61 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.937 0.398 . . . . 0.0 110.708 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.466 ' HA ' ' HE2' ' A' ' 8' ' ' MET . 61.2 Cg_endo -73.77 -18.11 22.34 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.675 2.25 . . . . 0.0 112.5 -177.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.39 1.73 43.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.295 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.445 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -87.26 143.47 27.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.1 0.476 . . . . 0.0 111.054 -179.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.443 HG12 ' H ' ' A' ' 17' ' ' ARG . 98.7 t -127.32 123.14 61.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.449 177.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -88.96 37.43 0.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.713 0.768 . . . . 0.0 111.475 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.443 ' H ' HG12 ' A' ' 15' ' ' VAL . 20.7 mtp180 -99.23 -55.86 2.57 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.596 170.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -105.47 -67.32 0.93 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.904 -168.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.537 ' HB3' HD21 ' A' ' 36' ' ' LEU . 3.9 m-20 -52.48 -39.69 61.48 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.54 -175.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.445 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 37.8 p90 -158.17 176.96 11.82 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 45.1 tt0 -152.47 148.8 27.84 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.931 0.396 . . . . 0.0 110.468 179.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 31' ' ' ILE . 17.2 mt -116.7 145.53 43.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.678 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.531 ' HD2' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mtt180 -141.99 148.44 38.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.256 0.551 . . . . 0.0 110.832 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -92.98 121.97 34.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.921 -175.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.75 -47.01 6.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.504 179.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.06 -35.25 1.86 Allowed Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -76.63 -25.56 53.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.921 0.867 . . . . 0.0 108.928 169.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 165.34 -175.09 41.19 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.251 -1.34 . . . . 0.0 111.549 -179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.5 m -108.35 108.97 20.17 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -121.66 -177.57 3.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.716 0.293 . . . . 0.0 111.315 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.427 ' HA ' HD23 ' A' ' 22' ' ' LEU . 13.2 mt -84.72 124.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.741 -175.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.531 ' HG2' ' HD2' ' A' ' 23' ' ' ARG . 0.6 OUTLIER -113.21 -18.92 11.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.849 0.357 . . . . 0.0 110.978 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.623 ' HB2' ' HZ2' ' A' ' 33' ' ' LYS . 3.8 ttmp? -126.38 140.81 52.21 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.0 t-105 -153.68 113.49 3.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.615 0.245 . . . . 0.0 110.624 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -117.79 -1.84 11.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.013 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 19' ' ' ASP . 88.0 mt -73.91 152.12 40.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.659 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.9 mtt180 -85.88 45.99 1.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.943 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -136.43 139.75 30.49 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.369 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.12 145.52 67.2 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.411 2.074 . . . . 0.0 111.469 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.2 mm? -65.7 127.38 93.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.782 -179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.432 ' HG2' HD21 ' A' ' 46' ' ' LEU . 30.5 Cg_endo -63.68 164.55 20.88 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.875 2.383 . . . . 0.0 112.028 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 p -97.2 172.29 7.9 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.342 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.406 HE21 ' HG3' ' A' ' 47' ' ' GLU . 26.4 tp60 -50.43 -55.2 16.86 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.093 179.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.85 77.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.135 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.86 -44.8 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.449 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.432 HD21 ' HG2' ' A' ' 41' ' ' PRO . 92.6 mt -61.55 -43.72 98.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.972 0.415 . . . . 0.0 111.21 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HG3' HE21 ' A' ' 43' ' ' GLN . 46.2 mt-10 -71.27 -29.02 64.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.294 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.1 m -62.98 -44.59 95.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.655 177.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.7 m0 -68.17 -37.45 81.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.419 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.584 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 66.4 t-105 -60.89 -49.4 77.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.788 174.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -58.32 -41.8 85.35 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.489 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.429 ' HB3' ' OH ' ' A' ' 9' ' ' TYR . 79.7 mt-10 -62.35 -45.51 92.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.012 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.425 HD13 ' HB2' ' A' ' 9' ' ' TYR . 67.3 tp -60.14 -32.77 71.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.787 0.327 . . . . 0.0 111.052 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 27.4 mm-40 -81.26 -40.57 23.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.815 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -85.17 -17.88 35.84 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.341 0.591 . . . . 0.0 112.39 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 57' ' ' PRO . 93.4 m-20 -99.37 143.53 26.6 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.826 -177.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 56' ' ' ASN . 41.4 Cg_exo -57.21 138.55 86.74 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.773 2.316 . . . . 0.0 111.223 175.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.84 173.49 11.85 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.439 2.093 . . . . 0.0 112.795 -177.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -49.18 123.42 7.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.606 174.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.123 -176.888 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ttt . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.658 0.266 . . . . 0.0 110.717 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.438 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.1 mp -95.85 106.02 17.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.707 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.4 mm? -71.42 -32.77 68.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.33 -175.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.435 ' CD1' HD11 ' A' ' 22' ' ' LEU . 87.0 t80 -51.35 -51.8 51.25 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.945 -174.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.85 -46.8 86.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.982 0.42 . . . . 0.0 111.065 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.511 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -61.76 -47.09 86.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.596 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.8 mt -65.83 -42.14 91.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.489 ' HE2' ' HA ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -63.81 -28.69 70.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.432 178.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -71.15 -36.62 72.12 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.963 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.627 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 85.1 tttt -86.85 -36.75 18.28 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.239 -179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -129.55 88.96 48.44 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.787 0.327 . . . . 0.0 111.054 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.489 ' HA ' ' HE2' ' A' ' 8' ' ' MET . 73.0 Cg_endo -77.24 -21.35 11.97 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.709 2.272 . . . . 0.0 113.146 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.56 5.99 45.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.428 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.22 147.1 23.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.542 ' HB ' ' HB3' ' A' ' 18' ' ' LYS . 38.9 t -95.32 128.29 46.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.019 0.438 . . . . 0.0 111.058 -176.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.6 m -61.68 138.54 58.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.812 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.532 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 0.7 OUTLIER 69.95 -3.82 1.64 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.571 0.748 . . . . 0.0 111.92 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.542 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 61.6 tttp -112.17 -61.12 1.76 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.777 0.322 . . . . 0.0 110.426 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.413 ' HB3' HD21 ' A' ' 36' ' ' LEU . 28.6 m-20 -85.91 -37.17 19.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.379 0.609 . . . . 0.0 109.974 177.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -134.07 114.42 13.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.947 173.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.557 ' HB3' ' HB3' ' A' ' 33' ' ' LYS . 43.7 tt0 -96.54 141.56 29.68 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.488 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.435 HD11 ' CD1' ' A' ' 4' ' ' TYR . 44.1 mt -107.59 153.3 23.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.097 0.475 . . . . 0.0 111.589 -172.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.608 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . 29.7 ttt180 -132.65 122.35 24.54 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.826 174.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.434 ' HA ' ' HA ' ' A' ' 29' ' ' SER . 47.5 t30 -97.19 116.02 28.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.186 0.517 . . . . 0.0 110.675 -178.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -95.56 -11.62 27.05 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.557 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.52 -47.26 1.07 Allowed Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 -174.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -71.49 -17.39 62.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.732 0.777 . . . . 0.0 109.794 174.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 164.95 161.75 14.56 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.999 178.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' ASN . 19.7 m -99.76 108.72 21.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.707 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 43.0 p90 -111.71 -168.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.685 0.279 . . . . 0.0 111.117 -176.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -76.54 122.99 32.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.087 0.47 . . . . 0.0 111.833 -174.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.608 ' HB2' ' HB2' ' A' ' 23' ' ' ARG . 9.2 tp10 -96.06 -61.67 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.157 172.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.557 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -119.98 119.04 32.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.115 -176.526 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -99.55 111.07 23.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -115.51 11.32 15.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.49 0.662 . . . . 0.0 110.1 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.413 HD21 ' HB3' ' A' ' 19' ' ' ASP . 84.2 mt -89.73 140.03 29.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -82.65 44.93 0.93 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.476 0.655 . . . . 0.0 110.351 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.05 147.3 65.29 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.417 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -55.5 145.15 70.39 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 123.016 2.477 . . . . 0.0 112.654 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.74 125.02 85.43 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.155 177.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.415 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 13.2 Cg_endo -58.58 147.35 87.28 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.912 2.408 . . . . 0.0 113.087 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.429 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 37.7 p -83.49 157.98 22.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.208 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.531 HE21 ' HG3' ' A' ' 47' ' ' GLU . 16.8 tp60 -57.43 -42.85 83.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.12 0.486 . . . . 0.0 110.296 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.49 -51.85 66.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.412 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.69 -42.45 98.01 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.662 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.46 HD22 HD11 ' A' ' 3' ' ' LEU . 90.5 mt -54.26 -53.52 52.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.198 177.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.531 ' HG3' HE21 ' A' ' 43' ' ' GLN . 46.4 mt-10 -71.22 -18.99 62.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.627 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 95.0 m -70.97 -46.69 61.9 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 174.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.627 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 24.7 m0 -61.5 -40.72 95.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.995 0.426 . . . . 0.0 109.876 177.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -60.11 -44.38 94.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.376 176.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -60.53 -49.48 77.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.457 178.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -63.68 -35.69 81.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.727 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.547 ' HA ' ' HD3' ' A' ' 57' ' ' PRO . 36.1 tp -63.99 -45.7 87.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.643 175.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -69.75 -27.97 65.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.024 0.44 . . . . 0.0 111.185 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -84.4 1.28 46.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.1 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.5 t30 63.45 99.0 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.337 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.012 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.547 ' HD3' ' HA ' ' A' ' 53' ' ' LEU . 76.0 Cg_endo -79.42 147.43 20.16 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.826 2.351 . . . . 0.0 112.074 -178.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.01 154.06 52.63 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.283 1.989 . . . . 0.0 112.292 178.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -70.84 132.87 45.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.573 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 C--N 1.33 -0.27 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 -179.641 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 120.576 0.227 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 30.4 mm -88.57 107.06 17.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 110.331 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.742 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 1.1 mm? -70.13 -35.57 74.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.873 0.368 . . . . 0.0 110.789 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.497 ' HB2' HD13 ' A' ' 22' ' ' LEU . 71.3 t80 -52.46 -50.65 62.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.924 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.473 ' OD1' HD11 ' A' ' 53' ' ' LEU . 0.7 OUTLIER -65.83 -38.36 88.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -174.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.54 -44.29 78.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.018 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 3' ' ' LEU . 87.9 mt -61.65 -49.21 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.427 179.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -69.56 -22.73 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.84 -177.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -67.66 -41.98 82.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -92.01 -40.11 11.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.255 -178.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -119.26 97.05 50.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.097 -176.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -74.61 -13.66 22.3 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.555 2.17 . . . . 0.0 111.419 175.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -87.4 2.2 51.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.441 ' HB1' ' CE1' ' A' ' 20' ' ' PHE . . . -87.3 105.35 17.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.958 0.409 . . . . 0.0 110.815 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.1 t -81.9 117.74 28.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.774 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m -69.36 149.87 47.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.578 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 64.83 22.41 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.525 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -146.06 -72.36 0.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.084 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.554 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 4.4 m-20 -80.41 -17.42 51.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.356 0.598 . . . . 0.0 110.429 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.441 ' CE1' ' HB1' ' A' ' 14' ' ' ALA . 40.3 p90 -160.07 144.81 14.79 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.092 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -118.91 131.21 56.04 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.729 0.3 . . . . 0.0 110.196 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' A' ' 4' ' ' TYR . 29.0 mt -102.77 153.35 20.25 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.457 ' O ' ' HA ' ' A' ' 29' ' ' SER . 4.1 mtt180 -137.4 148.24 46.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.675 174.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -89.33 126.88 35.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.222 -174.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.72 -13.07 16.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.735 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.54 -33.72 6.15 Favored Glycine 0 N--CA 1.453 -0.216 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -172.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -87.93 2.45 51.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.07 0.938 . . . . 0.0 109.1 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 130.86 176.12 14.29 Favored Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.449 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.457 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 19.3 m -104.69 122.5 45.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.767 0.317 . . . . 0.0 110.269 177.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.742 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 2.9 p90 -120.61 -179.75 4.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.353 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.83 120.68 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.416 -173.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -94.09 -58.33 2.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.165 0.507 . . . . 0.0 109.707 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -115.67 145.88 42.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.973 -178.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.2 t-105 -128.02 111.93 14.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.114 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -113.7 -2.83 13.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 -179.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.554 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 34.7 mt -66.02 140.75 58.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 72.9 mtm180 -84.85 39.53 0.76 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.683 0.754 . . . . 0.0 110.197 178.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -123.36 154.71 65.81 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.961 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -69.48 151.41 70.69 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.082 1.855 . . . . 0.0 112.222 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.0 mm? -71.24 116.66 49.24 Favored Pre-proline 0 N--CA 1.45 -0.467 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.17 175.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.408 ' HB3' ' HH2' ' A' ' 49' ' ' TRP . 33.3 Cg_endo -65.32 159.58 46.61 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.513 2.142 . . . . 0.0 112.224 178.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.2 p -92.29 167.58 11.91 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.45 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -55.5 -45.98 77.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.154 0.502 . . . . 0.0 110.005 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.84 91.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.178 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.3 -43.68 96.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.075 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.5 mt -60.17 -46.93 88.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.181 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -68.89 -24.44 64.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.338 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 92.9 m -63.68 -50.8 67.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.814 0.34 . . . . 0.0 110.779 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.408 ' HH2' ' HB3' ' A' ' 41' ' ' PRO . 8.8 m0 -70.46 -32.16 69.6 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.181 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -64.93 -41.85 95.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.783 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.38 -51.08 71.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.194 175.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -63.96 -30.84 71.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.071 0.462 . . . . 0.0 111.231 -178.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.473 HD11 ' OD1' ' A' ' 5' ' ' ASP . 6.6 tt -65.93 -38.25 88.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.154 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.74 -32.58 20.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.552 -178.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.99 -15.62 58.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.379 0.609 . . . . 0.0 110.578 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -139.77 87.94 12.54 Favored Pre-proline 0 C--N 1.315 -0.911 0 CA-C-N 115.013 -0.994 . . . . 0.0 108.854 171.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.49 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 19.9 Cg_endo -60.34 145.2 99.11 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.27 2.646 . . . . 0.0 113.029 -173.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 24.6 Cg_exo -63.94 167.92 13.1 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 123.021 2.481 . . . . 0.0 111.782 176.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -109.73 121.04 44.31 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.376 -177.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.227 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.554 ' H ' HD12 ' A' ' 2' ' ' ILE . 4.1 mp -74.0 106.35 3.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.489 ' HG ' HG13 ' A' ' 31' ' ' ILE . 2.5 mm? -64.49 -34.96 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.731 -173.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -51.23 -47.02 62.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.479 -175.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -68.87 -51.23 42.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.986 0.422 . . . . 0.0 110.884 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.479 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -57.1 -45.74 83.16 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.058 -178.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 3' ' ' LEU . 69.8 mt -65.69 -41.91 91.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -177.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 61.0 mtp -72.84 -19.14 61.37 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.101 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -74.65 -33.58 62.55 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 173.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -75.97 -54.45 6.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.679 178.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -120.69 91.95 47.58 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -63.43 -24.37 71.0 Favored 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.733 2.289 . . . . 0.0 112.817 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -93.76 10.67 32.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.809 0.338 . . . . 0.0 111.634 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -92.43 127.75 38.04 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.1 t -96.7 117.58 41.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-O 121.019 0.438 . . . . 0.0 111.192 -176.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -67.19 142.44 56.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 67.23 22.6 9.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.651 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -140.68 -69.41 0.39 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.065 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -93.35 -34.96 13.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.363 0.601 . . . . 0.0 109.609 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -130.47 132.27 45.58 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 170.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.614 ' HB2' ' HB3' ' A' ' 33' ' ' LYS . 49.0 mt-10 -114.19 127.8 56.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 121.265 0.555 . . . . 0.0 111.013 -175.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.466 ' O ' ' HD2' ' A' ' 23' ' ' ARG . 25.5 mt -109.43 149.71 29.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.432 178.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.533 ' HD3' ' HG2' ' A' ' 32' ' ' GLU . 5.6 mpt_? -130.7 164.66 24.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.903 0.382 . . . . 0.0 110.756 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -82.7 125.0 30.74 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.938 -174.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.428 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 15.8 t70 -91.1 -52.3 4.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.423 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 154.09 -35.32 0.72 Allowed Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.206 -176.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -121.4 34.45 5.19 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.83 179.78 17.11 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.788 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.8 m -113.21 137.53 51.33 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.428 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 21.7 p90 -121.6 175.57 6.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.727 0.299 . . . . 0.0 111.029 -176.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.489 HG13 ' HG ' ' A' ' 3' ' ' LEU . 39.9 mt -81.74 122.46 36.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.91 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.533 ' HG2' ' HD3' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -116.84 -33.05 4.91 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.569 175.324 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.614 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -124.18 133.08 53.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.55 0.214 . . . . 0.0 110.428 -179.019 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -134.34 109.49 8.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -108.25 -1.56 20.05 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.913 0.387 . . . . 0.0 110.711 -176.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.19 143.87 56.99 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.672 175.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -90.25 34.34 0.87 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.475 0.655 . . . . 0.0 109.949 -179.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -125.02 144.65 47.78 Favored Pre-proline 0 C--N 1.316 -0.888 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.739 -178.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -61.0 150.88 81.97 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.688 2.259 . . . . 0.0 112.287 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -66.41 139.76 96.35 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.656 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.97 166.12 19.45 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.846 2.364 . . . . 0.0 112.608 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.48 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 77.8 p -89.02 158.0 18.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.203 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -57.29 -43.58 83.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.281 0.562 . . . . 0.0 109.749 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.38 76.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.742 -1.117 . . . . 0.0 111.584 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -64.39 -41.35 96.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.745 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 42' ' ' THR . 95.8 mt -51.39 -50.0 60.45 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 111.132 176.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -62.23 -41.83 98.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.735 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.8 m -65.31 -34.69 78.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.378 -177.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.479 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 52.5 m0 -59.97 -45.86 91.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.022 0.439 . . . . 0.0 109.843 175.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 -62.45 -40.57 97.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.265 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.49 -50.29 73.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.069 177.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -61.06 -43.43 98.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.214 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.97 -36.0 82.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.508 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -34.35 33.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.243 -178.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -86.94 -11.05 51.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -57.23 126.88 75.39 Favored Pre-proline 0 C--N 1.315 -0.909 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.326 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -52.54 156.02 9.22 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.905 2.404 . . . . 0.0 112.38 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -41.95 136.85 3.33 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.857 3.038 . . . . 0.0 113.285 -177.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -70.54 127.79 33.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.396 -177.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 121.307 0.575 . . . . 0.0 110.448 177.988 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.469 HG22 ' H ' ' A' ' 4' ' ' TYR . 3.8 mp -117.72 132.4 67.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.809 -179.156 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.402 ' O ' HG13 ' A' ' 7' ' ' ILE . 1.9 mm? -59.66 -34.47 72.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.919 0.39 . . . . 0.0 111.579 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.469 ' H ' HG22 ' A' ' 2' ' ' ILE . 62.0 t80 -52.95 -53.24 52.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -60.86 -48.16 83.09 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.264 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.421 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -58.34 -51.0 71.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.614 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 3' ' ' LEU . 75.8 mt -62.39 -42.74 96.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.763 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.3 tpt -67.63 -24.96 65.51 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.882 -176.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -72.21 -45.22 61.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.878 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.717 ' HD2' ' CZ2' ' A' ' 49' ' ' TRP . 46.1 tttp -72.94 -49.86 26.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.66 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -115.62 94.8 41.56 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.888 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -67.54 -17.57 48.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.832 2.354 . . . . 0.0 111.814 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -95.85 9.51 40.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.909 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.868 ' HB1' ' HZ ' ' A' ' 20' ' ' PHE . . . -82.01 140.72 33.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.125 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.465 ' C ' ' H ' ' A' ' 17' ' ' ARG . 43.4 t -107.45 87.15 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.167 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 m -83.48 37.81 0.59 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 122.324 1.059 . . . . 0.0 109.581 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 15' ' ' VAL . 51.9 mtt180 -96.07 -53.96 3.47 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 113.517 -1.674 . . . . 0.0 111.137 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -145.05 -45.78 0.23 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.152 -163.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -61.94 -27.7 69.01 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.723 0.773 . . . . 0.0 109.514 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.868 ' HZ ' ' HB1' ' A' ' 14' ' ' ALA . 35.4 p90 -155.89 149.04 24.48 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.374 167.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 33' ' ' LYS . 31.8 tt0 -145.04 146.11 31.74 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.301 -170.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 39.0 mt -97.34 151.93 19.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 3.3 mpt_? -136.75 168.4 19.6 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.227 175.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -87.58 126.01 34.69 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.47 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 19.9 t70 -102.22 -15.53 16.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.299 0.571 . . . . 0.0 109.99 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.43 -53.34 0.8 Allowed Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.64 10.25 21.26 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.302 0.572 . . . . 0.0 109.924 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 144.18 -170.76 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.234 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 40.2 m -102.1 123.84 46.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.829 0.347 . . . . 0.0 110.607 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.47 ' CD1' ' HB2' ' A' ' 25' ' ' ASP . 1.2 p90 -122.7 177.81 5.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.355 -176.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.4 mt -75.38 121.05 26.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.226 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.51 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 26.3 tt0 -122.21 -46.08 2.2 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.987 177.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 32.5 mtmt -89.82 131.55 35.71 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -151.2 110.72 3.99 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -175.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -107.11 1.86 24.49 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.525 -175.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.7 mt -91.65 145.93 24.2 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.453 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 37' ' ' ARG . 58.5 mtt180 -83.22 48.02 1.33 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.757 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -126.97 145.86 55.48 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.49 -178.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.93 145.16 61.04 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.344 2.03 . . . . 0.0 111.305 174.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.89 134.02 95.93 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.596 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.79 158.95 22.45 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.487 2.791 . . . . 0.0 112.924 -178.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 59.9 p -88.64 158.68 18.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.078 -175.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -53.64 -44.77 69.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.242 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.11 -51.89 67.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.59 -43.43 96.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.484 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.2 mt -53.93 -47.41 71.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.896 0.379 . . . . 0.0 111.231 178.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -72.53 -29.25 63.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.483 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.9 m -69.33 -41.22 76.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.871 176.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.717 ' CZ2' ' HD2' ' A' ' 10' ' ' LYS . 37.9 m0 -60.08 -46.09 90.73 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 174.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -57.82 -48.74 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.593 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -56.84 -53.27 59.78 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.563 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -65.72 -30.36 71.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.442 -177.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.0 -38.79 89.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.909 0.385 . . . . 0.0 110.294 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.3 -30.9 38.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.161 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.41 ' O ' ' HD3' ' A' ' 57' ' ' PRO . 45.4 tttt -79.46 -15.5 57.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.682 -178.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -108.65 92.02 9.61 Favored Pre-proline 0 C--N 1.315 -0.933 0 N-CA-C 108.525 -0.916 . . . . 0.0 108.525 173.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.41 ' HD3' ' O ' ' A' ' 55' ' ' LYS . 31.3 Cg_exo -59.03 123.17 12.9 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.941 2.427 . . . . 0.0 113.018 -172.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.51 143.81 83.02 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.569 2.179 . . . . 0.0 110.812 174.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -99.19 148.18 24.36 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -174.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 C--N 1.323 -0.546 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.079 177.248 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 2' ' ' ILE . 4.3 mp -97.51 112.7 30.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.206 0.527 . . . . 0.0 110.446 -178.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.5 HD11 HD13 ' A' ' 46' ' ' LEU . 2.4 mm? -65.71 -33.35 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.035 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -52.37 -54.18 35.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.907 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.91 -44.67 96.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.337 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.68 -51.41 69.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.421 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.56 -41.62 92.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.607 0.241 . . . . 0.0 110.745 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.59 -13.95 62.59 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.584 -179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -82.19 -40.24 22.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -76.99 -51.75 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.741 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -118.14 98.17 51.26 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.137 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.15 -31.33 54.54 Favored 'Trans proline' 0 CA--C 1.528 0.211 0 C-N-CA 123.032 2.488 . . . . 0.0 113.123 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -102.61 19.49 18.97 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -176.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.88 119.53 24.52 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.52 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.423 ' C ' ' H ' ' A' ' 17' ' ' ARG . 47.5 t -84.7 88.55 2.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.548 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.486 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 9.9 p -85.89 36.73 0.68 Allowed 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.459 1.123 . . . . 0.0 110.24 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 15' ' ' VAL . 93.8 mtt180 -97.29 -60.34 1.6 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 113.629 -1.623 . . . . 0.0 110.988 175.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.5 tttp -128.89 -43.09 1.37 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 111.655 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.611 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 5.6 t70 -65.26 -34.74 79.07 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.486 ' CE2' ' HB3' ' A' ' 16' ' ' SER . 14.1 p90 -143.44 132.08 22.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 164.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -105.13 141.72 36.18 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.744 -169.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.5 mt -113.49 152.71 29.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.687 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -144.91 174.57 10.9 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.126 0.488 . . . . 0.0 109.828 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -129.99 117.53 20.21 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.763 -176.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.92 -27.18 57.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.297 0.57 . . . . 0.0 109.703 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.54 -42.37 1.17 Allowed Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.637 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -99.47 -0.07 41.48 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.443 0.639 . . . . 0.0 110.644 -176.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 177.22 155.99 14.97 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.226 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 15.8 m -105.05 122.16 45.29 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -130.84 -179.3 5.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.983 -173.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.3 mt -87.36 132.81 31.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.585 ' HG3' ' HD2' ' A' ' 33' ' ' LYS . 13.1 pt-20 -111.63 -34.01 6.19 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.24 176.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HD2' ' HG3' ' A' ' 32' ' ' GLU . 10.1 mptt -126.02 148.71 49.23 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 175.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -144.04 111.61 6.03 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 90.1 m-20 -123.06 13.66 9.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.704 0.288 . . . . 0.0 110.643 -178.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.416 HD23 ' OD2' ' A' ' 19' ' ' ASP . 48.0 mt -66.22 153.45 42.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.183 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 37' ' ' ARG . 62.2 mtt180 -82.13 42.35 0.73 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.127 178.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -152.4 154.58 32.16 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.484 -177.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.94 171.1 17.31 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.327 2.018 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -79.51 135.63 56.7 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.794 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.63 173.51 12.45 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.724 2.282 . . . . 0.0 111.819 176.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.617 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 34.2 p -99.11 161.4 13.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.073 -177.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.66 -44.76 85.93 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.07 -45.86 89.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.363 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.51 -45.01 95.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.656 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 42' ' ' THR . 91.6 mt -50.89 -50.47 57.13 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.494 0.496 . . . . 0.0 111.476 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -71.28 -28.62 64.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -178.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.9 m -66.03 -38.9 89.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.88 0.371 . . . . 0.0 110.31 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -63.17 -42.98 99.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 175.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -61.89 -44.73 96.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.373 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -61.09 -46.98 88.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.427 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -66.98 -28.7 68.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.281 . . . . 0.0 111.372 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.86 -54.8 21.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.842 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.99 -32.41 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.555 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -95.85 27.61 3.46 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -41.32 146.51 0.52 Allowed Pre-proline 0 N--CA 1.469 0.525 0 CA-C-N 114.949 -1.023 . . . . 0.0 113.425 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.07 163.96 32.16 Favored 'Trans proline' 0 C--O 1.236 0.412 0 C-N-CA 122.748 2.299 . . . . 0.0 111.563 175.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.9 157.49 61.54 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.397 2.065 . . . . 0.0 112.073 176.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -125.95 124.13 40.09 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.17 -179.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.272 179.872 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.5 mmm . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.649 0.261 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.7 mm -87.53 110.76 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 30' ' ' TYR . 2.3 mm? -69.22 -38.06 78.35 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.488 -175.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.407 ' CD1' HD11 ' A' ' 22' ' ' LEU . 27.7 t80 -54.73 -48.69 72.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.525 -176.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.4 -49.88 76.12 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.213 0.321 . . . . 0.0 111.016 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.407 ' HB1' ' HE3' ' A' ' 49' ' ' TRP . . . -59.88 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.587 -178.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.45 -43.55 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -23.13 66.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.855 -177.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -77.09 -48.61 17.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.194 -178.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.93 -27.72 23.18 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.73 0.3 . . . . 0.0 110.649 -177.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -116.16 83.62 12.83 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -67.15 -28.46 40.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.904 2.403 . . . . 0.0 113.211 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -111.26 27.14 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.659 -174.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.65 141.91 34.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.64 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.522 ' HB ' ' HB2' ' A' ' 19' ' ' ASP . 41.6 t -81.02 103.72 8.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.063 0.458 . . . . 0.0 111.144 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.0 m -69.82 140.29 53.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.234 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.1 mtt-85 71.12 11.96 6.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.556 173.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -140.4 -59.66 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.796 0.331 . . . . 0.0 110.452 173.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.522 ' HB2' ' HB ' ' A' ' 15' ' ' VAL . 0.5 OUTLIER -76.39 -26.31 55.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.265 0.555 . . . . 0.0 110.024 176.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -142.25 114.4 8.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 166.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -94.14 136.12 34.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.582 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.407 HD11 ' CD1' ' A' ' 4' ' ' TYR . 23.3 mt -105.86 152.79 22.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.626 -175.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.848 HH11 ' HG2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -139.74 155.51 47.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.366 174.236 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -88.35 109.6 20.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.882 -178.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.543 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 28.1 t70 -84.82 -42.84 14.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.08 0.467 . . . . 0.0 111.205 -178.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 149.37 -39.09 0.93 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.675 -177.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -107.19 27.84 8.65 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.62 179.52 15.81 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.124 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 23' ' ' ARG . 4.0 m -90.99 131.31 36.67 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.57 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 1.7 p90 -125.94 -177.95 4.12 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.0 mt -74.67 121.54 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.091 0.472 . . . . 0.0 111.449 -175.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.848 ' HG2' HH11 ' A' ' 23' ' ' ARG . 3.7 tp10 -100.22 -52.66 3.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 176.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -129.56 111.36 12.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.557 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -100.89 112.41 24.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 -177.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.466 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 80.6 m-20 -114.63 -6.12 12.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.621 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.462 ' HG ' ' HB3' ' A' ' 19' ' ' ASP . 36.5 mt -65.54 137.73 57.59 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.482 0.658 . . . . 0.0 111.278 -178.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -83.27 36.18 0.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.926 0.87 . . . . 0.0 109.901 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.409 ' H ' ' C ' ' A' ' 36' ' ' LEU . . . -125.08 147.48 57.15 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.458 -1.247 . . . . 0.0 109.751 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.08 144.61 94.6 Favored 'Trans proline' 0 C--O 1.238 0.525 0 C-N-CA 123.023 2.482 . . . . 0.0 113.011 178.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.403 ' HA ' ' HD2' ' A' ' 41' ' ' PRO . 4.3 mm? -66.31 126.86 92.79 Favored Pre-proline 0 N--CA 1.45 -0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.33 176.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.411 ' HB3' ' CH2' ' A' ' 49' ' ' TRP . 12.3 Cg_endo -57.69 150.83 59.29 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.019 2.479 . . . . 0.0 112.564 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 p -102.72 168.6 9.14 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.896 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -56.59 -54.57 44.48 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.938 -178.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.98 85.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.027 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.579 ' HB3' ' CZ2' ' A' ' 49' ' ' TRP . 34.0 mt-10 -57.44 -54.34 47.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.982 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.5 mt -51.68 -49.39 62.48 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.585 -178.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.19 -31.86 68.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.649 -177.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.2 m -67.36 -44.33 79.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.901 178.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.579 ' CZ2' ' HB3' ' A' ' 45' ' ' GLU . 15.5 m0 -64.18 -39.49 94.12 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.585 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 62.6 t-105 -60.31 -49.14 78.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.173 176.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -62.36 -43.89 97.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.717 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.98 -36.55 83.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 121.239 -0.184 . . . . 0.0 110.742 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -64.18 -39.91 94.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.806 0.336 . . . . 0.0 110.504 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.585 ' HG2' ' O ' ' A' ' 50' ' ' TRP . 26.9 mm-40 -66.9 -37.18 83.89 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.424 0.631 . . . . 0.0 109.963 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -86.97 5.63 36.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.043 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -99.93 138.86 20.42 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.19 -176.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -61.6 133.42 45.44 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.917 2.411 . . . . 0.0 111.805 174.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -53.01 141.2 57.71 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.976 2.451 . . . . 0.0 113.224 -176.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -80.12 124.66 28.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.48 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 . . . . . 0 C--N 1.327 -0.391 0 O-C-N 123.427 0.454 . . . . 0.0 110.324 178.866 . . . . . . . . 0 0 . 1 stop_ save_