data_2ltt_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 2ltt _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 . . . . . . . . . . . . . 75.8 mmm . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 121.001 0.429 . . . . 10.0 110.084 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.06 160.16 25.91 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.383 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -64.16 -49.41 72.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 10.0 110.25 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -134.55 108.32 8.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.098 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.6 tp -82.77 134.7 35.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.095 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -70.31 139.18 52.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.93 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 p90 -166.57 175.08 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.488 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -158.51 134.01 8.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 52.2 mt -80.79 111.82 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.9 mm -83.4 -45.96 18.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.591 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -159.31 132.43 7.04 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.107 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.0 127.44 33.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 75.9 mt -99.99 -74.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.474 -0.49 . . . . 10.0 111.931 -178.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.44 HD12 ' O ' ' A' ' 13' ' ' LEU . 29.2 mm -130.09 144.16 38.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.086 0.469 . . . . 10.0 112.212 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.3 p -124.48 123.86 67.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.324 -0.991 . . . . 10.0 108.324 177.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.2 mt -91.02 -80.36 0.34 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.366 -0.534 . . . . 10.0 111.046 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 175.51 -177.42 0.11 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.086 0.554 . . . . 10.0 109.782 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.487 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 36.4 mp0 -97.26 164.08 12.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.38 -166.4 1.08 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -29.23 70.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.395 0.617 . . . . 10.0 109.874 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -87.91 -1.84 58.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.21 -0.905 . . . . 10.0 110.309 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.64 0.15 89.23 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.672 -0.775 . . . . 10.0 112.041 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.487 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.6 m0 -52.95 107.07 0.19 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 122.493 0.317 . . . . 10.0 111.794 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.552 ' O ' ' HA ' ' A' ' 43' ' ' THR . 14.7 tpp85 -79.97 100.28 8.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.411 ' HZ1' ' CD ' ' B' ' 61' ' ' GLU . 78.3 mttt -82.59 112.75 19.76 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.751 -178.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -139.25 161.67 36.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.638 0.733 . . . . 10.0 111.975 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 35.3 tp -130.37 108.07 9.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.569 -1.196 . . . . 10.0 108.521 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -135.62 157.38 47.01 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.832 0.349 . . . . 10.0 110.508 -178.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 29' ' ' ARG . 8.6 ttp180 -97.51 114.66 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 23.9 m -124.69 162.16 27.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.769 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 2.4 p -95.31 122.23 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.925 0.393 . . . . 10.0 110.635 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.1 m0 -63.86 109.46 1.76 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.768 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 60.11 29.55 19.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.931 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 t0 61.63 35.11 17.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.803 -1.09 . . . . 10.0 110.715 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.64 -76.8 0.58 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.01 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -92.48 116.16 66.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.45 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 61.3 Cg_endo -81.63 120.6 3.56 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.514 2.143 . . . . 10.0 111.049 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -149.88 159.55 44.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.686 0.279 . . . . 10.0 110.48 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -78.68 133.95 37.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.895 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -144.43 129.01 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 12.8 tt -106.13 122.44 59.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.289 0.566 . . . . 10.0 110.486 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.426 ' CZ ' ' H ' ' A' ' 54' ' ' GLY . 2.8 mtp85 -149.14 174.27 12.52 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.252 -178.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.552 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.8 p -124.19 138.44 54.41 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.625 -0.879 . . . . 10.0 108.625 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -117.89 176.92 4.98 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 121.081 -0.248 . . . . 10.0 110.987 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -66.13 150.7 96.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.365 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.04 -38.16 96.59 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.91 2.407 . . . . 10.0 112.65 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -88.11 5.7 39.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.893 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 57.86 28.05 15.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.277 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -81.03 -31.91 34.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.451 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -140.71 174.79 10.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 10.0 111.587 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.79 172.59 10.69 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.012 -0.994 . . . . 10.0 110.929 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.35 -170.26 11.81 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.734 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.424 ' HA ' ' NH2' ' A' ' 42' ' ' ARG . 22.4 mttp -103.62 141.77 35.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 10.0 112.301 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.426 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -141.0 -117.46 1.37 Allowed Glycine 0 N--CA 1.453 -0.192 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -152.78 142.12 14.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 117.381 0.591 . . . . 10.0 110.976 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 m -96.77 135.13 39.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.333 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 65.3 mt -115.02 117.44 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -78.58 169.96 17.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.567 -0.288 . . . . 10.0 110.558 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -57.38 -44.86 84.78 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.164 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.43 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 7.4 pt-20 -54.97 -45.04 74.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.854 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.43 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 34.8 mt-10 -69.26 -59.77 2.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.008 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.562 ' CE2' HD12 ' A' ' 66' ' ' LEU . 3.5 t80 -52.32 -42.15 63.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.73 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.68 -59.68 10.33 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.233 -0.508 . . . . 10.0 112.648 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 72.3 t -64.63 -41.28 91.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.99 0.424 . . . . 10.0 110.604 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.1 tp -57.67 -54.24 49.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.807 -179.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.562 HD12 ' CE2' ' A' ' 62' ' ' PHE . 17.2 mt -62.37 -43.24 99.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.702 -0.226 . . . . 10.0 111.464 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -53.43 -50.77 64.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.196 0.522 . . . . 10.0 110.733 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.616 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 41.8 mm-40 -71.5 -48.82 46.53 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.384 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.8 mt -57.37 -45.45 84.43 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.742 0.275 . . . . 10.0 111.742 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.69 -38.06 95.28 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 111.322 -0.711 . . . . 10.0 111.322 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -73.51 -25.21 60.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.869 0.366 . . . . 10.0 110.758 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.616 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.82 -29.02 68.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.883 0.373 . . . . 10.0 110.685 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 36.9 mt -87.72 3.14 49.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.146 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 C--O 1.252 1.184 0 CA-C-O 118.607 -0.711 . . . . 10.0 109.998 179.495 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mmm . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.916 0.389 . . . . 10.0 110.58 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.44 161.22 16.38 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.487 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.514 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 26.7 t70 -64.13 -50.26 68.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.183 0.516 . . . . 10.0 109.754 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.514 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 40.7 mmtm -135.02 109.88 8.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.672 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -83.88 135.82 34.35 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.992 -0.373 . . . . 10.0 109.992 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.411 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.2 tppt? -71.34 137.37 48.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.161 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -164.59 177.25 8.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.256 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -159.88 131.97 6.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . 0.402 ' HA ' HG12 ' B' ' 30' ' ' VAL . 51.4 mt -78.37 108.87 12.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 10.0 110.697 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.3 mm -80.02 -50.23 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.139 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -156.51 130.75 8.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.949 -0.568 . . . . 10.0 111.237 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.08 132.14 35.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 57.4 mt -103.87 -71.42 0.73 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.648 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.434 HD11 ' CB ' ' A' ' 68' ' ' GLU . 19.8 mm -131.8 142.37 43.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.978 0.418 . . . . 10.0 111.946 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.8 p -124.26 121.51 61.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.277 -1.009 . . . . 10.0 108.277 177.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 37.0 mt -88.24 -80.54 0.27 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.615 -0.434 . . . . 10.0 111.489 -178.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 175.25 -178.01 0.11 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.491 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 35.3 mp0 -97.15 163.76 12.79 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.77 -164.01 0.89 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.921 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.33 -23.57 64.72 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.294 0.568 . . . . 10.0 110.3 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -93.8 -0.35 55.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.937 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.39 0.03 89.36 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.829 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.491 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.5 m0 -53.59 107.62 0.27 Allowed 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.554 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.1 tpp85 -80.46 100.2 8.39 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -81.5 113.19 19.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.857 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -139.74 162.03 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.519 0.676 . . . . 10.0 112.037 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 32.8 tp -131.76 107.14 8.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.725 -1.125 . . . . 10.0 108.517 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -135.5 155.95 49.68 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.634 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -96.18 114.53 26.24 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.402 HG12 ' HA ' ' B' ' 9' ' ' ILE . 17.0 m -122.91 162.19 23.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.443 -179.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.0 p -94.97 121.96 37.13 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.949 0.404 . . . . 10.0 110.373 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -63.63 109.92 1.84 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.661 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.411 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.9 m-80 60.54 28.14 17.81 Favored 'General case' 0 N--CA 1.462 0.14 0 O-C-N 123.781 0.676 . . . . 10.0 110.115 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.0 t70 65.91 25.29 11.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.585 -1.189 . . . . 10.0 110.982 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.74 -78.41 0.58 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.13 -0.356 . . . . 10.0 111.916 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -87.48 117.17 68.2 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.775 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.412 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 58.9 Cg_endo -82.82 119.45 2.91 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.143 1.896 . . . . 10.0 110.971 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 12.3 ttpt -148.51 158.38 44.08 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 121.01 -0.276 . . . . 10.0 110.471 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -78.6 133.08 37.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.457 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -143.72 129.25 19.09 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . 0.414 ' HB ' HD13 ' B' ' 27' ' ' LEU . 12.1 tt -106.67 122.5 60.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.287 0.565 . . . . 10.0 110.525 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.426 ' NH2' ' HA ' ' B' ' 53' ' ' LYS . 3.2 mtp85 -149.23 175.07 11.71 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.332 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.554 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.4 p -125.17 138.3 54.14 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.8 m-90 -117.88 176.87 5.0 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.921 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.8 m -64.99 150.79 94.76 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.581 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.39 -42.27 69.93 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.788 2.325 . . . . 10.0 112.408 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -88.36 11.75 15.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.117 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 53.48 33.35 15.89 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.563 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -84.02 -32.79 24.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.371 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -141.32 174.31 10.66 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.325 0.584 . . . . 10.0 111.351 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.27 173.05 9.58 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.711 -1.131 . . . . 10.0 110.646 -178.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.72 -169.21 11.56 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.979 -0.629 . . . . 10.0 112.578 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . 0.426 ' HA ' ' NH2' ' B' ' 42' ' ' ARG . 18.3 mttp -102.26 144.59 30.58 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.237 0.541 . . . . 10.0 112.033 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -144.18 -120.25 1.41 Allowed Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 110.73 -0.948 . . . . 10.0 110.73 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -151.65 142.38 15.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 117.309 0.555 . . . . 10.0 110.603 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 2.5 m -96.55 136.09 37.54 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.648 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.83 117.53 30.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.324 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.65 171.18 15.51 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.664 -0.243 . . . . 10.0 110.534 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -58.39 -44.83 89.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.98 0.419 . . . . 10.0 110.323 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.423 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.4 pt-20 -55.13 -45.03 75.58 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.894 178.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.423 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 33.5 mt-10 -70.25 -60.52 2.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.936 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -52.83 -38.27 61.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.658 -0.701 . . . . 10.0 111.553 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.96 -57.9 16.41 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.157 -0.544 . . . . 10.0 112.616 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 43.4 t -66.76 -40.07 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.442 . . . . 10.0 110.423 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.0 tp -58.21 -53.18 61.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.604 -0.725 . . . . 10.0 111.03 -179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 55.9 mt -60.3 -49.89 75.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.273 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.7 tttm -50.78 -51.58 49.16 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.464 0.477 . . . . 10.0 111.657 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.591 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 21.9 mm-40 -70.41 -49.2 51.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.71 -179.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.429 ' HB3' HD21 ' A' ' 66' ' ' LEU . 60.8 mt -59.81 -42.74 94.15 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.49 -39.4 97.78 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -72.88 -25.44 61.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.065 0.459 . . . . 10.0 111.037 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.591 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.6 mmtt -66.44 -29.67 69.86 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.997 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.483 ' CD1' ' HB3' ' A' ' 66' ' ' LEU . 26.1 mt -90.97 5.15 49.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.999 -0.28 . . . . 10.0 111.395 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 . . . . . 0 C--O 1.25 1.102 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 178.117 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.971 0.415 . . . . 10.0 110.653 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -111.11 173.22 6.44 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.56 -54.95 8.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -137.41 104.18 5.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.846 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.8 tp -73.46 145.97 45.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.164 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -76.12 131.53 39.47 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.055 0.455 . . . . 10.0 110.583 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.1 p90 -156.16 166.52 33.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.808 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.506 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.5 tp10 -150.95 124.35 8.92 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.505 -0.554 . . . . 10.0 109.505 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.2 mt -75.67 110.23 10.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.031 0.443 . . . . 10.0 110.106 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.5 mm -80.92 -43.34 20.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.43 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -164.22 128.13 2.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.972 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -76.45 135.22 39.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.584 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 95.9 mt -105.93 -74.84 0.64 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.78 -0.368 . . . . 10.0 111.809 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.424 HD11 ' HB3' ' B' ' 68' ' ' GLU . 23.8 mm -132.71 138.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.338 0.59 . . . . 10.0 112.318 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.01 119.8 59.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 107.693 -1.225 . . . . 10.0 107.693 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.439 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.7 mt -88.85 -80.85 0.28 Allowed 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.382 -0.527 . . . . 10.0 111.816 -178.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -175.67 -171.94 0.5 Allowed 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.443 -0.577 . . . . 10.0 109.443 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.7 mp0 -105.47 140.92 37.84 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -79.21 -170.78 2.4 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -26.03 68.27 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.566 0.698 . . . . 10.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.9 mttt -91.28 4.55 52.06 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.028 -0.987 . . . . 10.0 110.921 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.22 7.27 87.95 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.454 -0.879 . . . . 10.0 110.98 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -62.14 101.4 0.22 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 10.0 111.416 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.7 tpp85 -81.48 103.25 11.09 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.932 -0.577 . . . . 10.0 109.671 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -86.5 113.29 22.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.798 0.333 . . . . 10.0 110.153 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -129.93 146.94 51.64 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.353 0.597 . . . . 10.0 111.464 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.584 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 26.3 tp -114.05 108.0 16.42 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.716 -1.216 . . . . 10.0 107.716 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -134.44 152.95 52.11 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.944 0.402 . . . . 10.0 111.27 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -86.67 114.65 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.77 158.3 41.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.941 0.401 . . . . 10.0 110.828 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.506 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.9 p -97.13 125.05 41.36 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.629 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.6 m0 -64.49 108.04 1.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.652 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.441 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.3 m-80 60.03 29.06 18.66 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 123.776 0.672 . . . . 10.0 110.488 -178.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.4 t70 66.75 18.0 10.64 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.928 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.6 -79.15 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.988 -0.445 . . . . 10.0 111.918 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -97.19 124.92 47.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -178.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.474 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.3 Cg_endo -83.85 121.81 2.91 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 123.017 2.478 . . . . 10.0 111.874 178.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.44 ' HD2' ' CG2' ' A' ' 56' ' ' THR . 13.8 ttmm -143.98 167.24 22.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -88.42 133.54 34.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.503 0.192 . . . . 10.0 110.746 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.492 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -146.89 130.09 16.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.486 ' HB ' HD12 ' A' ' 27' ' ' LEU . 10.6 tt -104.56 122.9 58.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.492 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.2 mtt85 -142.04 -178.38 5.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -177.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -113.44 142.17 46.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.962 -1.017 . . . . 10.0 112.02 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -123.7 164.3 19.39 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.48 -0.782 . . . . 10.0 109.007 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.2 p -78.37 158.89 76.01 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.27 -20.91 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.431 2.087 . . . . 10.0 112.283 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.28 0.53 25.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.177 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 56.26 37.01 28.43 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.647 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -90.62 -39.73 12.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.274 0.559 . . . . 10.0 109.975 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -134.04 174.64 10.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.344 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -147.88 172.94 13.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.963 -177.544 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.6 -162.17 10.91 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.319 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -98.9 152.13 20.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.671 . . . . 10.0 111.694 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -140.98 -122.32 1.85 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.326 -0.71 . . . . 10.0 111.326 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.9 tt -151.65 140.84 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.265 0.555 . . . . 10.0 111.154 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.44 ' CG2' ' HD2' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -99.79 144.3 29.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.17 -179.894 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.84 128.62 47.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.17 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.19 163.9 26.13 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.924 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -55.6 -48.51 74.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.854 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.32 -47.64 83.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 10.0 111.076 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -61.04 -45.39 94.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.686 ' CE2' HD13 ' A' ' 66' ' ' LEU . 26.9 t80 -60.94 -45.19 95.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.268 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.33 -52.22 53.98 Favored Glycine 0 N--CA 1.451 -0.3 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.722 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.4 t -62.25 -42.27 94.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.877 0.37 . . . . 10.0 110.478 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -58.12 -54.4 47.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.794 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.686 HD13 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -63.39 -43.09 98.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.15 -0.22 . . . . 10.0 111.578 -179.137 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.0 tttm -52.78 -51.33 61.13 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 26.0 mm-40 -71.03 -45.32 64.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.599 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.5 mt -59.19 -43.66 92.19 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.664 0.269 . . . . 10.0 111.099 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.68 -38.31 96.22 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.574 -0.822 . . . . 10.0 111.084 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -69.68 -28.76 66.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.996 0.426 . . . . 10.0 110.491 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.9 mmtt -68.71 -30.23 68.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.07 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 41.8 mt -86.17 -11.44 52.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.192 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.562 -0.732 . . . . 10.0 110.835 -179.821 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.751 0.31 . . . . 10.0 110.518 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.52 175.68 5.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.4 -55.08 6.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.046 0.451 . . . . 10.0 109.865 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' B' ' 4' ' ' LYS . 13.3 mmmm -136.54 103.65 5.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.543 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.12 144.27 47.03 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.098 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.9 tppt? -75.8 128.56 35.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.331 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.9 p90 -153.52 165.84 34.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.119 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.501 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.6 tp10 -150.51 124.49 9.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.58 110.22 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.199 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -80.77 -41.49 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.335 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -164.71 129.23 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.927 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.68 137.89 39.67 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.419 -0.956 . . . . 10.0 108.419 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.564 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 95.1 mt -108.96 -73.15 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.022 -0.671 . . . . 10.0 111.997 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.418 HD13 ' CB ' ' A' ' 68' ' ' GLU . 15.3 mm -131.22 139.45 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.984 0.421 . . . . 10.0 111.848 -177.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.7 117.2 49.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 177.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -85.7 -80.8 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.798 -0.361 . . . . 10.0 111.677 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.1 m -179.21 -171.61 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 50.3 mp0 -103.08 142.77 33.55 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.131 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -81.21 -171.07 3.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.96 -0.563 . . . . 10.0 109.531 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -18.81 65.56 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.368 0.604 . . . . 10.0 110.918 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 17.7 mttt -97.84 3.99 49.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.308 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.94 6.28 86.93 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.509 -0.853 . . . . 10.0 111.293 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -62.04 102.53 0.29 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.911 0.386 . . . . 10.0 111.372 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 16.4 tpp85 -81.72 102.27 10.63 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.831 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.72 113.75 22.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.711 0.291 . . . . 10.0 110.299 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -130.87 147.67 52.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.241 0.543 . . . . 10.0 111.193 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.564 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 28.8 tp -115.22 107.87 15.86 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.908 -1.145 . . . . 10.0 107.908 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -133.72 154.11 51.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.867 0.365 . . . . 10.0 111.047 -177.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -88.05 114.19 24.42 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.361 -0.977 . . . . 10.0 108.361 178.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 16.2 m -127.37 158.1 38.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.791 0.329 . . . . 10.0 110.703 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.501 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.2 p -96.81 124.83 40.9 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.941 0.401 . . . . 10.0 110.565 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -63.97 108.68 1.56 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.574 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.486 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 61.9 m-80 58.66 30.69 20.24 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.369 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 36.0 t70 67.31 14.91 9.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.81 -1.087 . . . . 10.0 111.557 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.35 -81.35 0.47 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.053 0.39 . . . . 10.0 112.053 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -94.45 124.83 54.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 71.0 Cg_endo -83.14 124.13 3.7 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.743 2.296 . . . . 10.0 112.032 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.92 164.46 31.94 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -87.07 130.77 34.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.337 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.462 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.2 t0 -144.58 131.17 19.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . 0.52 ' HB ' HD12 ' B' ' 27' ' ' LEU . 10.8 tt -105.22 123.0 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.462 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.9 mtp85 -142.33 -178.08 5.57 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.606 0.595 . . . . 10.0 112.606 -177.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -114.28 143.11 45.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.976 -1.011 . . . . 10.0 112.149 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 54.7 m95 -123.56 166.19 15.86 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.488 -0.778 . . . . 10.0 108.906 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -80.02 159.31 71.11 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.2 -26.1 67.96 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.578 2.186 . . . . 10.0 112.471 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -104.03 0.36 29.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.582 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER 58.84 37.29 24.89 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.577 -0.738 . . . . 10.0 111.766 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -89.87 -38.94 13.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.148 0.499 . . . . 10.0 110.384 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -134.86 174.35 10.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.321 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' MET . . . . . 0.43 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -147.01 173.07 12.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.929 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.98 -162.55 10.98 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.142 -0.552 . . . . 10.0 112.277 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -96.95 154.2 17.44 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.013 -0.698 . . . . 10.0 111.708 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.44 -122.62 1.77 Allowed Glycine 0 C--N 1.331 0.264 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.384 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.2 tt -152.53 139.84 13.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 117.276 0.538 . . . . 10.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.23 141.96 31.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.1 mt -124.61 126.24 45.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.157 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -73.81 164.56 26.48 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.385 -0.371 . . . . 10.0 110.149 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -58.4 -44.48 89.0 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.474 ' O ' HG21 ' B' ' 64' ' ' VAL . 8.2 pt-20 -65.54 -43.92 88.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 10.0 110.793 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -64.82 -47.64 77.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.385 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.613 ' CE2' HD12 ' B' ' 66' ' ' LEU . 12.5 t80 -59.44 -40.22 86.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.799 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.72 -53.33 46.22 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.595 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.474 HG21 ' O ' ' B' ' 60' ' ' GLU . 20.1 t -62.05 -42.15 93.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 120.924 0.392 . . . . 10.0 110.261 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.9 tp -58.28 -54.19 49.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.937 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.613 HD12 ' CE2' ' B' ' 62' ' ' PHE . 45.9 mt -61.17 -48.72 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.08 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -50.15 -53.86 24.71 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.75 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 24.3 mm-40 -69.22 -45.69 69.22 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.872 -178.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.454 HD11 ' CD2' ' A' ' 66' ' ' LEU . 70.8 mt -61.09 -42.34 98.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.612 0.244 . . . . 10.0 111.279 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.98 -38.13 96.09 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.673 -0.971 . . . . 10.0 110.673 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -70.09 -30.54 67.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.294 -0.453 . . . . 10.0 110.508 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.9 mmtt -65.65 -31.31 72.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.559 -0.291 . . . . 10.0 111.35 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 29.4 mt -90.36 -3.07 57.96 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.45 -0.786 . . . . 10.0 109.926 179.664 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 mmt . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.819 0.343 . . . . 10.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -93.01 169.46 10.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.698 -0.482 . . . . 10.0 109.698 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.99 -47.4 71.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.081 0.467 . . . . 10.0 110.005 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -137.51 113.92 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.148 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.5 tp -85.1 143.15 29.03 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -78.35 131.67 37.09 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.021 0.439 . . . . 10.0 110.376 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.9 p90 -152.14 171.57 17.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.798 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.533 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.2 tp10 -152.23 121.66 6.82 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.799 -0.445 . . . . 10.0 109.799 179.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 53.2 mt -79.37 105.7 9.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.904 0.383 . . . . 10.0 110.578 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.36 -51.96 19.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.184 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -162.72 130.54 3.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.141 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.92 144.17 41.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.664 -0.495 . . . . 10.0 109.664 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 71.9 mt -109.28 -75.17 0.63 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.783 -0.367 . . . . 10.0 111.915 -178.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.1 mm -128.7 141.69 45.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -177.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -125.13 123.33 65.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 178.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.2 mt -92.24 -79.85 0.38 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.544 -0.462 . . . . 10.0 111.276 -178.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.09 -167.33 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.502 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.7 mp0 -108.53 145.38 34.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.769 0.318 . . . . 10.0 110.516 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -82.28 -173.46 4.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.31 -22.34 66.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.397 0.618 . . . . 10.0 110.509 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -88.62 -1.64 58.17 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.279 -0.873 . . . . 10.0 110.84 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 3.47 81.93 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.611 -0.804 . . . . 10.0 111.294 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.502 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.32 105.5 0.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.693 0.282 . . . . 10.0 111.355 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.4 tpp85 -85.47 100.31 11.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.409 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 93.2 mttt -82.45 115.84 21.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.617 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -134.68 147.31 50.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.792 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.44 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 35.9 tp -116.88 111.76 20.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.43 -0.805 . . . . 10.0 108.956 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -131.54 163.69 27.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 10.0 111.556 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -98.57 113.75 25.91 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.1 m -131.21 159.2 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.007 0.432 . . . . 10.0 111.269 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -96.65 125.14 40.91 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.145 178.821 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.1 m0 -63.81 108.99 1.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.525 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.451 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 58.21 31.93 21.4 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.481 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.8 t70 66.68 23.4 10.24 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 114.981 -1.009 . . . . 10.0 111.2 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.62 -88.27 0.46 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.102 -0.374 . . . . 10.0 111.745 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -95.57 124.88 51.51 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.536 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 59.6 Cg_endo -77.57 128.46 9.5 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.814 2.342 . . . . 10.0 111.851 178.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -147.94 170.06 18.52 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -94.98 131.21 41.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.213 -0.291 . . . . 10.0 110.213 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -142.42 132.01 23.91 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.5 tt -108.09 123.46 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.272 0.558 . . . . 10.0 110.059 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HG2' ' HA3' ' A' ' 54' ' ' GLY . 3.4 mtt85 -145.79 177.41 8.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.133 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -124.64 142.55 51.3 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.446 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 28.7 m95 -117.56 171.14 8.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -65.55 156.92 80.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.23 -31.15 75.03 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.607 2.204 . . . . 10.0 112.618 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -97.28 2.79 51.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.178 0.513 . . . . 10.0 110.578 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 59.06 26.81 15.58 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.926 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -78.1 -37.07 47.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.116 0.484 . . . . 10.0 110.824 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -133.57 175.01 9.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.923 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.446 ' HB3' ' CE3' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -138.78 172.55 12.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.366 -0.834 . . . . 10.0 111.104 -177.088 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.85 -163.05 9.36 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.177 -0.535 . . . . 10.0 112.116 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -94.89 155.38 16.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.949 -0.736 . . . . 10.0 112.322 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.418 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.3 -127.05 1.43 Allowed Glycine 0 CA--C 1.518 0.245 0 N-CA-C 110.686 -0.966 . . . . 10.0 110.686 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -148.89 142.63 18.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 117.606 0.703 . . . . 10.0 111.198 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.47 141.15 34.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.839 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -122.09 129.4 52.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.962 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.1 m -74.23 164.97 25.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.013 -0.366 . . . . 10.0 110.013 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.47 -46.68 89.04 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.646 0.239 . . . . 10.0 111.646 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -61.96 -40.8 96.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 10.0 110.488 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.467 ' HB3' HD11 ' B' ' 16' ' ' LEU . 87.5 mt-10 -64.33 -49.79 70.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.357 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.654 ' CE2' HD12 ' A' ' 66' ' ' LEU . 15.1 t80 -57.86 -44.84 86.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.276 -0.874 . . . . 10.0 111.314 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.91 -52.16 53.88 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.284 -0.484 . . . . 10.0 112.477 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.411 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 93.0 t -63.34 -45.06 99.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 110.332 -0.247 . . . . 10.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 24.1 tp -56.19 -52.15 65.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.654 HD12 ' CE2' ' A' ' 62' ' ' PHE . 20.9 mt -62.54 -44.91 95.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.417 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.1 tttm -53.1 -52.02 59.97 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 123.567 0.542 . . . . 10.0 110.818 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.682 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 44.8 mm-40 -66.54 -51.99 50.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.428 -0.806 . . . . 10.0 111.212 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 74.2 mt -56.12 -48.32 76.43 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.184 0.439 . . . . 10.0 112.184 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.28 -39.05 96.66 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.344 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -71.23 -20.72 62.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.032 0.444 . . . . 10.0 111.117 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.682 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.7 mmtt -77.41 -26.68 51.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.601 -0.272 . . . . 10.0 110.796 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 24.5 mt -82.96 -19.2 37.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.996 -0.281 . . . . 10.0 111.297 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.385 -0.817 . . . . 10.0 110.887 -179.605 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.2 mmt . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.712 0.291 . . . . 10.0 110.336 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.53 168.52 11.2 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.422 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 28.9 t70 -68.85 -46.7 67.82 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 39.5 mmtm -137.19 107.7 6.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.176 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 31.1 tp -79.89 141.07 36.45 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.45 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.7 tppt? -77.35 130.17 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.249 0.547 . . . . 10.0 110.738 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -150.94 173.36 14.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.699 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.541 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.4 tp10 -154.72 122.79 5.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 52.9 mt -78.77 108.88 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.133 0.492 . . . . 10.0 110.784 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -78.87 -47.64 22.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.039 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -167.59 130.55 1.66 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.112 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -75.22 145.77 41.72 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 81.2 mt -112.0 -74.66 0.63 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.477 -0.489 . . . . 10.0 111.902 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 16.0 mm -127.24 140.8 48.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.025 0.44 . . . . 10.0 111.903 -177.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.93 122.48 62.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.078 -1.082 . . . . 10.0 108.078 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . 0.467 HD11 ' HB3' ' A' ' 61' ' ' GLU . 28.8 mt -92.06 -81.29 0.34 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.373 -0.531 . . . . 10.0 111.778 -178.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -179.18 -167.71 0.11 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.15 147.55 31.12 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.348 -0.242 . . . . 10.0 110.348 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -85.15 -172.15 4.02 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.34 -20.82 66.19 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.472 0.654 . . . . 10.0 110.464 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -90.21 -2.55 58.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.177 -0.92 . . . . 10.0 110.323 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 4.52 80.85 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.478 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.7 m0 -62.33 105.99 0.69 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.748 0.308 . . . . 10.0 111.333 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.473 ' O ' ' HA ' ' B' ' 43' ' ' THR . 12.3 tpp85 -85.21 100.31 11.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.593 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.415 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 93.9 mttt -82.06 115.73 21.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.735 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -134.23 146.61 50.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.859 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.489 HD12 ' HB ' ' B' ' 41' ' ' ILE . 42.7 tp -115.92 111.86 21.03 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.668 -0.864 . . . . 10.0 108.668 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -132.34 162.29 31.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.126 0.488 . . . . 10.0 111.623 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.1 ttm180 -97.7 113.91 25.77 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 22.8 m -131.55 157.12 43.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.904 0.383 . . . . 10.0 111.297 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.541 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -94.19 125.3 38.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.194 178.785 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -63.88 109.2 1.68 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.543 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.45 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.5 m-80 58.5 32.91 22.65 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.831 0.707 . . . . 10.0 110.368 -178.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 67.63 17.79 9.9 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.946 -1.025 . . . . 10.0 111.414 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.04 -89.77 0.38 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.13 0.419 . . . . 10.0 112.13 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -90.96 123.32 65.06 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 112.271 0.471 . . . . 10.0 112.271 -177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.529 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.87 126.75 8.98 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.831 2.354 . . . . 10.0 111.701 178.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.402 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 18.6 ttmm -147.07 170.78 16.43 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . 0.402 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 6.3 m-85 -96.94 129.22 44.43 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.325 -0.25 . . . . 10.0 110.325 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.417 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.56 132.25 28.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.279 -0.638 . . . . 10.0 109.279 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . 0.489 ' HB ' HD12 ' B' ' 27' ' ' LEU . 13.2 tt -106.82 122.7 61.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.324 0.583 . . . . 10.0 110.16 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.417 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -145.6 176.8 9.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.002 -0.544 . . . . 10.0 111.257 -178.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.473 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -123.85 142.92 50.68 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.332 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 m95 -117.15 173.37 6.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.103 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.0 m -67.87 157.79 85.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -55.44 -31.44 77.87 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.504 2.136 . . . . 10.0 112.48 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -99.3 6.08 46.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.464 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.48 28.39 15.42 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.102 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.58 -38.45 40.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.725 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -133.41 174.23 10.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.112 0.482 . . . . 10.0 111.128 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.4 172.22 13.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.165 -0.925 . . . . 10.0 111.199 -177.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.88 -161.25 8.67 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.984 -0.627 . . . . 10.0 111.797 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -97.79 153.16 18.47 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 122.17 -0.606 . . . . 10.0 112.485 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.61 -124.26 1.46 Allowed Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.403 -1.079 . . . . 10.0 110.403 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -153.16 143.25 14.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 117.549 0.675 . . . . 10.0 111.219 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.5 143.78 31.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.383 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 63.7 mt -123.19 129.08 50.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.08 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.0 m -74.59 163.09 28.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.79 -44.86 93.74 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 -178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.503 ' O ' HG22 ' B' ' 64' ' ' VAL . 10.1 pt-20 -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.133 0.492 . . . . 10.0 110.465 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.143 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.522 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -58.01 -41.36 82.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.544 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.53 -52.84 50.52 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.06 -0.59 . . . . 10.0 112.059 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.503 HG22 ' O ' ' B' ' 60' ' ' GLU . 28.0 t -63.96 -45.0 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 10.0 110.139 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.8 tp -55.72 -51.43 67.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.012 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 65.4 mt -61.19 -48.92 79.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.976 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 46.6 tttm -52.58 -52.54 54.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.549 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.624 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 51.2 mm-40 -65.94 -53.18 42.47 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.558 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.462 ' HB3' HD23 ' A' ' 66' ' ' LEU . 61.3 mt -57.96 -44.06 86.8 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.158 0.429 . . . . 10.0 112.158 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.2 -41.04 99.36 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 111.191 -0.764 . . . . 10.0 111.191 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -72.24 -22.5 61.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.314 -0.443 . . . . 10.0 111.565 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.6 mmtt -72.41 -26.55 61.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 22.5 mt -88.3 -5.88 58.08 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.151 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.453 -0.784 . . . . 10.0 109.884 179.716 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.223 0 CA-C-O 120.69 0.281 . . . . 10.0 110.619 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.12 164.32 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.148 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.6 -48.05 42.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.225 0.536 . . . . 10.0 109.762 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -139.48 95.19 2.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.305 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 22.4 tp -68.93 146.33 52.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.439 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 35.3 tptt -79.37 134.83 36.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.652 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -161.87 166.73 25.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.222 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.482 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -151.8 133.07 14.49 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.635 -0.505 . . . . 10.0 109.635 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.4 mt -79.85 111.24 16.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.601 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -82.12 -45.81 19.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.056 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -164.73 127.5 2.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.839 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -80.05 142.07 35.27 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 48.5 mt -112.12 -73.74 0.66 Allowed 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.409 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.449 HD13 ' O ' ' A' ' 13' ' ' LEU . 29.0 mm -130.23 138.2 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.71 118.3 56.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 107.403 -1.332 . . . . 10.0 107.403 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.434 HD22 ' HB ' ' B' ' 64' ' ' VAL . 28.1 mt -85.81 -82.12 0.2 Allowed 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.138 -0.625 . . . . 10.0 111.808 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.2 m -174.97 -166.34 0.23 Allowed 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.538 -0.541 . . . . 10.0 109.538 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.435 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.4 mp0 -109.78 143.15 40.01 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.89 -0.411 . . . . 10.0 109.89 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -81.69 -171.82 3.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.79 -27.93 69.52 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.492 0.663 . . . . 10.0 110.391 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -87.55 3.2 48.43 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.031 -0.986 . . . . 10.0 111.0 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.11 6.27 88.32 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.545 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.435 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -61.9 103.71 0.38 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 10.0 111.416 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.45 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.9 tpp85 -81.26 99.53 8.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.185 178.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.426 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 93.0 mttt -83.96 121.04 26.84 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.957 0.408 . . . . 10.0 110.762 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -136.12 153.34 51.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.944 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 42.6 tp -123.02 106.96 11.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.918 . . . . 10.0 108.646 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -136.58 156.49 48.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.176 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -95.69 114.58 26.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.4 m -121.86 161.97 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.469 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.482 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -94.39 123.86 38.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.01 0.433 . . . . 10.0 110.43 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.97 108.41 1.49 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.619 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.7 m-80 60.81 27.4 17.2 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.003 -178.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.6 t70 68.62 19.57 8.57 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.938 -1.028 . . . . 10.0 110.914 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.92 -80.09 0.57 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.97 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.68 118.76 69.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -178.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.9 Cg_endo -77.95 120.3 5.0 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.621 2.214 . . . . 10.0 110.711 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -145.8 162.97 36.44 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.867 -0.333 . . . . 10.0 110.788 -177.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -86.57 128.32 34.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.558 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.419 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -143.03 131.46 22.24 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 17.9 tt -107.2 123.29 62.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.178 0.513 . . . . 10.0 110.099 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.419 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.1 mtt85 -145.32 177.6 8.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.458 -178.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.45 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -124.96 143.95 50.62 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.726 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 m95 -117.71 173.8 6.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.142 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 p -76.64 156.18 83.07 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.23 -27.62 85.49 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.726 2.284 . . . . 10.0 112.715 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -97.37 -4.58 38.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.651 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.29 34.01 16.17 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.45 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -83.93 -39.36 19.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.762 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -140.56 173.74 11.2 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.21 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.55 172.78 12.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.943 -177.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.32 -164.88 10.22 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 121.001 -0.619 . . . . 10.0 112.499 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.5 mttp -95.01 151.92 18.76 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.113 -0.639 . . . . 10.0 112.375 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.78 -128.43 1.89 Allowed Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.277 -0.874 . . . . 10.0 111.479 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -147.34 145.82 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 CA-C-N 117.727 0.764 . . . . 10.0 111.233 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -104.96 144.4 31.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.382 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.8 mt -122.43 135.16 54.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.771 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.427 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 3.4 m -77.46 164.51 25.37 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.127 -0.324 . . . . 10.0 110.127 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -59.39 -48.63 80.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.663 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.25 -43.57 97.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.965 0.412 . . . . 10.0 110.804 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.427 ' CD ' ' HG ' ' A' ' 58' ' ' SER . 91.4 mt-10 -59.14 -48.89 79.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.246 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.495 ' CE2' HD13 ' A' ' 66' ' ' LEU . 33.5 t80 -58.06 -42.15 84.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.006 -0.997 . . . . 10.0 111.167 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.75 34.4 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.277 -0.487 . . . . 10.0 112.489 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 71.5 t -60.38 -43.7 94.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-O 120.969 0.414 . . . . 10.0 110.165 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.45 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -56.48 -52.85 63.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.542 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.495 HD13 ' CE2' ' A' ' 62' ' ' PHE . 17.5 mt -62.12 -45.67 92.43 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -52.37 -52.42 53.64 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.431 0.457 . . . . 10.0 111.19 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 52.1 mm-40 -68.69 -48.39 64.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.433 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.2 mt -58.97 -45.09 91.41 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.672 0.249 . . . . 10.0 111.672 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.76 -37.18 94.32 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.688 -0.767 . . . . 10.0 111.575 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -71.92 -30.06 64.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.82 0.343 . . . . 10.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 44.9 mmtt -64.63 -27.91 69.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.01 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 23.3 mt -88.75 -2.13 58.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 10.0 111.78 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.651 -179.592 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.801 0.334 . . . . 10.0 110.667 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.78 167.22 10.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.598 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -76.39 -47.94 21.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -139.46 99.2 3.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.231 -0.895 . . . . 10.0 110.102 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp -72.88 142.04 47.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.12 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 10.3 tppt? -77.15 134.39 38.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.948 0.404 . . . . 10.0 110.215 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -160.81 165.17 30.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.897 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.449 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.3 tp10 -149.24 131.96 15.95 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 61.2 mt -77.39 112.95 15.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.08 0.467 . . . . 10.0 110.147 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.0 mm -84.45 -42.8 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.096 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -168.35 127.99 1.22 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.644 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -81.41 140.13 34.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 55.7 mt -111.36 -67.19 1.01 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.496 -0.482 . . . . 10.0 112.244 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.465 HD13 ' CB ' ' A' ' 68' ' ' GLU . 12.0 mm -133.97 136.51 53.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 10.0 111.86 -177.14 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 p -120.74 120.04 61.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.233 -1.395 . . . . 10.0 107.233 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -87.04 -81.86 0.22 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.369 -0.532 . . . . 10.0 111.967 -177.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 5.4 m -177.26 -167.75 0.17 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.117 -0.697 . . . . 10.0 109.117 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.407 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 4.3 mp0 -107.07 143.48 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -82.79 -172.63 4.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.06 -25.38 68.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.31 0.576 . . . . 10.0 110.817 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -90.1 2.04 55.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.493 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.1 6.96 84.12 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.493 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.407 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.4 m0 -62.64 103.54 0.43 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.605 0.24 . . . . 10.0 111.613 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -80.35 99.98 8.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.437 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 92.3 mttt -84.23 119.81 25.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 10.0 110.754 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -135.5 151.59 50.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.991 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 39.2 tp -121.62 107.24 12.15 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -136.63 155.5 49.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.283 -178.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -94.81 115.0 26.96 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 m -122.26 161.68 22.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.46 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.449 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.4 p -94.34 123.49 37.78 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.273 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -63.53 109.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.448 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.4 m-80 59.06 30.9 20.82 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 123.734 0.646 . . . . 10.0 109.785 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 63.94 26.27 14.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.924 -1.035 . . . . 10.0 111.159 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.24 -78.17 0.58 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.729 -0.388 . . . . 10.0 111.755 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -88.75 117.02 67.88 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 47.9 Cg_endo -77.93 120.06 4.93 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.292 1.995 . . . . 10.0 110.481 178.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -146.08 164.0 33.51 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.895 -0.322 . . . . 10.0 110.442 -178.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -88.11 128.45 35.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.505 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -142.94 131.91 22.94 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.379 -0.601 . . . . 10.0 109.379 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . 0.402 ' HB ' HD11 ' B' ' 27' ' ' LEU . 8.1 tt -107.03 123.22 62.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 121.514 0.673 . . . . 10.0 110.289 -179.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 4.1 mtt85 -145.54 177.55 8.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.394 -178.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -125.47 144.49 50.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.854 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 42.0 m95 -118.06 174.03 6.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.312 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -77.3 156.65 81.38 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -30.01 87.3 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.652 2.234 . . . . 10.0 112.704 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -98.16 -2.94 38.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.934 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.03 31.38 13.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.545 -179.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -79.63 -39.18 32.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.967 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.19 174.05 10.96 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.36 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' MET . . . . . 0.401 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -136.02 172.99 12.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 10.0 110.927 -178.147 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -136.47 -163.08 9.71 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.113 -0.565 . . . . 10.0 112.273 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -97.4 149.01 22.6 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.033 -0.686 . . . . 10.0 112.33 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.45 -129.11 2.43 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.342 -0.845 . . . . 10.0 111.003 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -147.82 146.68 17.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.343 0.572 . . . . 10.0 110.397 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -104.38 145.36 30.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.58 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.5 mt -123.09 133.72 54.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.691 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' SER . . . . . 0.477 ' HG ' ' CD ' ' B' ' 61' ' ' GLU . 1.9 m -76.58 164.25 26.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.11 -46.92 88.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.829 0.307 . . . . 10.0 111.829 -178.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.459 ' O ' HG21 ' B' ' 64' ' ' VAL . 8.0 pt-20 -65.46 -41.57 93.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.477 ' CD ' ' HG ' ' B' ' 58' ' ' SER . 90.1 mt-10 -61.15 -49.25 77.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.156 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.96 -39.02 80.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.629 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.18 -52.24 53.17 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.934 -0.65 . . . . 10.0 112.287 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.459 HG21 ' O ' ' B' ' 60' ' ' GLU . 12.1 t -63.37 -44.71 99.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 10.0 110.05 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 15.7 tp -54.87 -52.36 63.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.816 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 77.9 mt -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.989 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -49.89 -53.93 22.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.642 -0.708 . . . . 10.0 111.871 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.523 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 13.8 mm-40 -68.84 -47.89 64.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.97 -0.559 . . . . 10.0 112.093 -178.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.468 ' HB3' HD23 ' A' ' 66' ' ' LEU . 69.0 mt -61.65 -43.53 98.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.746 0.308 . . . . 10.0 111.696 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -35.65 92.34 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.517 -0.633 . . . . 10.0 111.517 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . 0.428 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 21.1 t-20 -74.55 -27.63 60.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 10.0 110.872 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.5 mmtt -65.55 -29.04 69.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.837 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 26.0 mt -90.71 6.64 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.965 -0.294 . . . . 10.0 111.655 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . 0.428 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.2 mt-10 . . . . . 0 C--O 1.245 0.829 0 CA-C-O 118.197 -0.906 . . . . 10.0 110.525 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.15 155.44 17.74 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.58 -55.29 24.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 10.0 109.815 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -132.35 93.89 3.34 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.335 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 20.2 tp -65.81 150.79 48.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.355 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 15.4 tppt? -77.63 133.25 38.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.636 0.255 . . . . 10.0 110.455 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -159.14 167.95 27.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.52 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -154.11 129.48 9.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 49.1 mt -79.13 112.58 17.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.142 0.496 . . . . 10.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -79.42 -40.18 21.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.653 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -169.02 141.91 2.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.247 -0.888 . . . . 10.0 110.347 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.89 135.95 33.17 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.615 -0.883 . . . . 10.0 108.615 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 91.2 mt -104.24 -75.29 0.62 Allowed 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.573 -0.451 . . . . 10.0 111.375 -179.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 13' ' ' LEU . 32.6 mm -131.68 139.22 51.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 10.0 112.074 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.9 p -122.63 125.79 73.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 107.622 -1.251 . . . . 10.0 107.622 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.465 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -93.89 -81.05 0.38 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.214 -0.595 . . . . 10.0 111.813 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.5 m -177.76 -169.78 0.23 Allowed 'General case' 0 C--O 1.237 0.4 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 -179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.0 mp0 -104.27 140.62 37.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.374 . . . . 10.0 110.001 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -80.61 -172.0 3.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.61 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.2 -26.47 68.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.716 0.77 . . . . 10.0 110.855 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -91.65 3.93 53.89 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.736 -1.12 . . . . 10.0 111.243 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.23 5.89 89.25 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.518 -0.849 . . . . 10.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -62.95 104.05 0.51 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.928 0.394 . . . . 10.0 110.919 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 43' ' ' THR . 10.5 tpp85 -81.69 99.74 9.08 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.668 -0.696 . . . . 10.0 109.473 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -82.43 117.28 22.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.947 0.403 . . . . 10.0 110.713 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -131.53 148.88 52.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.165 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.525 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 43.2 tp -119.06 107.77 13.91 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 178.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -135.11 163.03 30.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.931 0.396 . . . . 10.0 110.746 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -98.66 114.85 27.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.9 m -125.64 157.87 34.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 10.0 111.01 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.52 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 3.3 p -94.71 123.64 38.27 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.098 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -64.25 110.04 2.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.638 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.43 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.8 m-80 60.53 29.38 18.97 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 123.796 0.685 . . . . 10.0 110.452 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 61.83 34.37 17.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 114.692 -1.14 . . . . 10.0 110.594 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.5 -77.43 0.59 Allowed 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.26 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -88.66 115.24 62.89 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.667 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.419 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.1 Cg_endo -78.26 121.01 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.517 2.145 . . . . 10.0 111.292 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -149.73 163.38 38.11 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.948 -0.301 . . . . 10.0 110.698 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -85.51 135.29 33.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.439 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -148.84 132.1 16.47 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.9 tt -107.21 122.11 60.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.325 0.583 . . . . 10.0 109.945 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.439 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.4 mtt85 -143.83 179.36 7.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.209 -177.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.495 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -125.9 145.18 50.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.027 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.5 m95 -117.48 173.85 6.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.214 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.5 p -78.76 159.34 74.14 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -59.47 -27.22 84.41 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.354 2.036 . . . . 10.0 112.422 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -96.11 -0.86 49.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.249 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 55.7 34.89 24.23 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.752 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -92.55 -39.8 11.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.753 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -131.58 174.29 10.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.693 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.424 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -153.4 173.1 16.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.032 -177.674 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.77 -159.56 9.25 Favored Glycine 0 C--O 1.226 -0.38 0 C-N-CA 120.941 -0.647 . . . . 10.0 111.977 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -93.65 161.33 14.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.272 0.536 . . . . 10.0 112.3 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.96 -127.28 1.3 Allowed Glycine 0 CA--C 1.519 0.333 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.974 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -147.88 143.27 19.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 117.838 0.819 . . . . 10.0 111.269 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -100.85 145.92 27.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.231 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.1 mt -125.41 127.1 46.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.849 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.514 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 1.4 m -76.37 163.02 27.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.008 -0.367 . . . . 10.0 110.008 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -55.9 -50.67 70.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.934 0.346 . . . . 10.0 111.934 -178.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -61.61 -46.37 90.13 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.789 0.328 . . . . 10.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.514 ' CD ' ' HG ' ' A' ' 58' ' ' SER . 78.4 mt-10 -60.27 -47.82 84.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.114 0.483 . . . . 10.0 110.476 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.437 ' CE2' HD13 ' A' ' 66' ' ' LEU . 28.2 t80 -59.43 -46.82 87.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.282 -0.872 . . . . 10.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.75 -53.29 46.4 Favored Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 116.178 -0.464 . . . . 10.0 112.578 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.476 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 88.6 t -61.21 -45.55 98.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.674 0.273 . . . . 10.0 110.28 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.534 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 23.2 tp -54.66 -53.05 59.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.669 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.437 HD13 ' CE2' ' A' ' 62' ' ' PHE . 18.4 mt -62.62 -44.45 96.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.323 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -51.98 -50.35 61.45 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.063 0.459 . . . . 10.0 110.943 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 56.7 mm-40 -68.13 -49.53 60.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.146 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 91.1 mt -58.27 -43.86 88.16 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.662 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.09 96.5 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.335 -0.706 . . . . 10.0 111.335 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -73.08 -28.59 62.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.625 0.25 . . . . 10.0 110.72 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 70.1 mmtt -66.67 -28.0 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.644 -0.253 . . . . 10.0 111.467 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 23.1 mt -85.8 -16.24 39.41 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.096 -0.242 . . . . 10.0 111.54 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.486 -0.769 . . . . 10.0 110.715 -179.194 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 120.796 0.332 . . . . 10.0 110.169 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.41 154.55 18.97 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.04 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.414 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 19.0 t70 -62.53 -56.07 21.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.361 0.601 . . . . 10.0 109.711 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.414 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 13.3 mmmm -131.96 95.01 3.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.256 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 20.9 tp -65.77 149.5 50.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.598 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -76.51 132.99 39.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.405 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -160.09 167.5 27.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.45 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.7 tp10 -153.07 129.18 10.4 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . 0.405 ' HA ' HG12 ' B' ' 30' ' ' VAL . 68.7 mt -78.03 111.24 14.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.348 0.594 . . . . 10.0 110.555 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 mm -78.77 -41.52 24.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.776 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -169.14 139.21 2.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.34 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.74 141.45 30.53 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 83.5 mt -111.02 -70.46 0.81 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.139 -0.624 . . . . 10.0 111.617 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 18.3 mm -132.86 139.61 49.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.061 0.458 . . . . 10.0 111.582 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.7 p -124.62 123.61 66.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 107.807 -1.182 . . . . 10.0 107.807 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 41.4 mt -92.73 -81.85 0.34 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.391 -0.524 . . . . 10.0 111.803 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.34 -170.45 0.22 Allowed 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 -179.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -102.84 139.39 38.47 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -79.08 -171.46 2.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.84 -17.82 65.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.431 0.634 . . . . 10.0 111.055 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -99.3 5.87 46.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.76 3.51 90.47 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.529 -0.843 . . . . 10.0 111.181 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -61.78 104.11 0.41 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.885 0.374 . . . . 10.0 111.039 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.7 tpp85 -82.82 100.0 10.05 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.621 179.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -82.11 117.47 22.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.899 0.381 . . . . 10.0 110.758 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -131.67 146.78 52.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.08 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 44.3 tp -117.56 107.16 13.93 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -135.22 161.81 34.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.498 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -99.43 115.05 28.37 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.405 HG12 ' HA ' ' B' ' 9' ' ' ILE . 23.0 m -124.63 159.37 30.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.76 -178.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.45 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.4 p -95.8 124.01 39.63 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.306 179.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -63.84 112.64 2.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.678 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 58.63 29.46 18.55 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.472 -177.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 62.94 32.96 15.35 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.068 -0.969 . . . . 10.0 111.099 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.06 -70.7 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.95 0.352 . . . . 10.0 111.95 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -92.46 113.59 59.84 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.738 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.07 119.95 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.393 2.062 . . . . 10.0 110.753 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.4 ttpt -148.9 163.9 36.08 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.709 0.29 . . . . 10.0 110.37 -178.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -87.63 135.57 33.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.922 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.422 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -149.13 132.22 16.3 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . 0.428 ' HB ' HD12 ' B' ' 27' ' ' LEU . 8.9 tt -106.84 123.58 61.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.206 0.527 . . . . 10.0 109.855 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.422 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.7 mtt85 -144.56 179.78 7.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.234 -177.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -126.23 144.87 50.62 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.037 -0.528 . . . . 10.0 109.954 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 36.4 m95 -117.8 174.52 6.13 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.039 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -79.08 160.08 71.84 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.713 -0.477 . . . . 10.0 109.713 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.63 -27.23 84.45 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.193 1.929 . . . . 10.0 112.103 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -95.78 -4.33 44.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.272 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.06 31.81 20.76 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.117 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -89.18 -39.77 13.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.982 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -131.63 173.17 11.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.872 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' MET . . . . . 0.421 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -150.95 172.45 15.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.772 -177.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.21 -159.72 9.42 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.318 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -93.65 156.97 16.4 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.083 -0.657 . . . . 10.0 112.262 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.62 -128.41 1.91 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.766 -0.934 . . . . 10.0 110.766 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -146.84 143.47 20.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 117.618 0.709 . . . . 10.0 110.796 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -100.83 144.52 29.68 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.771 -0.649 . . . . 10.0 111.642 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -123.62 127.29 48.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.051 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' SER . . . . . 0.46 ' HG ' ' CD ' ' B' ' 61' ' ' GLU . 1.4 m -77.03 165.98 23.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.142 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -59.82 -47.69 84.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.524 ' O ' HG21 ' B' ' 64' ' ' VAL . 11.0 pt-20 -65.65 -43.74 88.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.897 0.38 . . . . 10.0 110.866 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.46 ' CD ' ' HG ' ' B' ' 58' ' ' SER . 73.0 mt-10 -62.41 -47.37 84.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.414 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.406 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.0 t80 -61.96 -41.36 97.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.727 -0.67 . . . . 10.0 110.612 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.59 -53.28 47.33 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.197 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.524 HG21 ' O ' ' B' ' 60' ' ' GLU . 23.3 t -61.33 -47.47 93.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 10.0 110.216 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.5 tp -53.62 -51.62 62.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.889 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.439 HD23 ' HB3' ' A' ' 69' ' ' LEU . 56.6 mt -61.07 -48.61 80.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.139 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -52.05 -51.21 59.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.463 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' B' ' 64' ' ' VAL . 58.9 mm-40 -66.57 -50.73 62.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.67 -0.695 . . . . 10.0 111.582 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.421 HD11 ' CD2' ' A' ' 66' ' ' LEU . 95.6 mt -60.58 -40.74 92.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.952 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.54 -40.81 99.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.51 -0.853 . . . . 10.0 111.092 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -72.0 -28.68 63.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.644 0.259 . . . . 10.0 111.215 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -66.01 -26.45 67.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.593 0.22 . . . . 10.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 21.0 mt -90.07 -10.27 45.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.944 -0.303 . . . . 10.0 111.514 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.425 -0.798 . . . . 10.0 109.89 179.712 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 121.003 0.43 . . . . 10.0 110.564 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.44 172.67 7.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.024 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -74.7 -51.8 13.31 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.742 -0.466 . . . . 10.0 109.742 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.53 94.05 3.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.946 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.17 144.47 57.18 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 14.7 tppt? -78.1 130.84 36.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.932 0.396 . . . . 10.0 110.471 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -157.0 172.33 18.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.644 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -154.88 134.76 12.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 56.4 mt -82.87 111.65 19.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 10.0 110.56 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.12 -47.66 19.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.507 -0.769 . . . . 10.0 110.201 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -160.99 130.82 4.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.001 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.61 129.07 35.14 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.554 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 55.8 mt -98.95 -75.66 0.55 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.285 -0.566 . . . . 10.0 111.632 -178.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.516 HD12 ' O ' ' A' ' 13' ' ' LEU . 28.8 mm -134.39 141.11 44.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.992 0.425 . . . . 10.0 112.029 -177.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 p -121.8 122.67 67.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.087 -1.079 . . . . 10.0 108.087 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.403 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -90.78 -80.65 0.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.303 -0.559 . . . . 10.0 111.882 -177.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -175.17 -167.62 0.28 Allowed 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.469 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 3.5 mp0 -115.84 134.77 54.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.792 0.33 . . . . 10.0 110.338 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -73.12 -174.2 1.49 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.15 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.51 -26.12 68.56 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 121.553 0.692 . . . . 10.0 110.418 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -85.24 -2.04 57.61 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.0 -1.0 . . . . 10.0 110.868 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.75 6.19 83.12 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.76 -0.936 . . . . 10.0 110.76 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.469 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.3 m0 -62.01 103.66 0.39 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.031 0.443 . . . . 10.0 111.513 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.545 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.6 tpp85 -80.88 99.1 8.16 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.29 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.495 ' HZ3' ' CD ' ' B' ' 61' ' ' GLU . 90.8 mttt -83.2 113.26 20.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.064 0.459 . . . . 10.0 110.614 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -132.01 150.06 52.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.416 -0.811 . . . . 10.0 111.238 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.554 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 44.6 tp -117.85 109.34 16.43 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.664 -1.236 . . . . 10.0 107.664 178.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -134.76 156.94 47.97 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.087 0.47 . . . . 10.0 111.326 -177.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.1 ttm180 -96.85 114.55 26.19 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 10.0 108.781 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 m -126.73 159.98 35.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.8 0.334 . . . . 10.0 110.943 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.454 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.0 OUTLIER -95.62 122.99 38.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.316 179.125 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -64.47 111.43 2.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.897 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.407 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.2 m-80 59.47 29.07 18.59 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.816 0.698 . . . . 10.0 110.286 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.4 t0 66.72 24.42 9.97 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.468 -1.242 . . . . 10.0 111.143 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.69 -91.58 0.44 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.534 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -83.88 123.92 75.34 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.722 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.9 Cg_endo -82.29 122.59 3.72 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.025 2.483 . . . . 10.0 111.701 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -142.89 164.56 29.75 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.769 -0.373 . . . . 10.0 110.128 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -89.35 128.86 35.94 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.422 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -139.71 131.46 27.45 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.411 ' HB ' HD12 ' A' ' 27' ' ' LEU . 9.5 tt -108.0 121.28 60.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.521 0.676 . . . . 10.0 109.952 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.422 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.5 mtt85 -144.75 -178.14 5.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.069 -177.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.545 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -126.11 144.41 50.75 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.781 179.499 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -117.14 179.75 3.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.894 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 p -81.95 161.37 60.88 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 -32.19 93.68 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.292 1.995 . . . . 10.0 112.156 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.96 -5.96 54.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.403 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 62.12 36.26 15.25 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.545 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -93.89 -40.48 10.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.857 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -126.94 172.26 10.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.448 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.438 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -152.45 173.34 15.24 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.35 -177.762 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -134.06 -161.37 9.59 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.263 -0.97 . . . . 10.0 112.589 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -89.87 154.83 19.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.003 0.43 . . . . 10.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.403 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.35 -128.02 1.52 Allowed Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.163 -0.926 . . . . 10.0 111.156 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -143.33 143.5 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 117.755 0.777 . . . . 10.0 111.192 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.06 140.81 39.28 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.323 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.39 128.71 49.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.544 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 69.8 m -84.34 170.24 13.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.492 -0.322 . . . . 10.0 110.551 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -52.9 -51.94 59.39 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.106 0.78 . . . . 10.0 113.106 -178.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.99 -46.67 86.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.743 0.306 . . . . 10.0 111.463 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.506 ' CD ' ' HZ3' ' B' ' 25' ' ' LYS . 47.8 mt-10 -62.07 -48.73 78.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.21 0.528 . . . . 10.0 110.67 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -61.77 -43.11 99.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.217 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.68 -52.41 53.21 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.862 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.7 t -60.62 -41.55 88.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.14 0.495 . . . . 10.0 110.083 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.481 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.7 tp -59.11 -55.25 37.42 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.422 -0.808 . . . . 10.0 110.667 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.443 HD21 ' HB3' ' B' ' 69' ' ' LEU . 16.5 mt -59.45 -47.02 87.09 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -48.86 -55.59 11.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.593 -0.73 . . . . 10.0 111.626 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.491 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 62.6 mm-40 -72.28 -41.99 66.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.768 -178.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.0 mt -59.66 -45.89 90.67 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.637 0.256 . . . . 10.0 111.583 -179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.06 -36.78 93.41 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.367 -0.921 . . . . 10.0 111.076 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -67.55 -25.0 65.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 10.0 110.891 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.7 mmtt -72.37 -26.88 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.447 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.412 HD11 ' HB3' ' B' ' 66' ' ' LEU . 35.2 mt -88.14 -18.74 28.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.637 0.256 . . . . 10.0 111.009 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.594 -0.717 . . . . 10.0 111.044 -179.529 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.897 0.38 . . . . 10.0 110.425 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.82 167.06 10.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -70.82 -53.98 13.29 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 20.7 mmtm -132.76 94.26 3.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.835 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 27.2 tp -65.57 142.23 58.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.808 0.337 . . . . 10.0 110.268 179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.431 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.9 tppt? -75.26 126.98 32.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.58 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -153.01 171.69 17.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.914 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.523 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.7 tp10 -155.15 132.01 10.73 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 53.4 mt -81.22 114.46 22.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.203 0.525 . . . . 10.0 110.633 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.1 mm -86.42 -41.0 14.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -166.17 130.04 2.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.651 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.86 132.24 39.05 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.736 -0.838 . . . . 10.0 108.736 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 29.3 mt -102.97 -72.91 0.68 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.384 -0.526 . . . . 10.0 111.76 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.431 HD11 ' CB ' ' A' ' 68' ' ' GLU . 14.0 mm -136.66 137.94 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.918 0.389 . . . . 10.0 112.016 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 p -119.0 122.98 70.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.6 mt -90.67 -80.34 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.599 -0.44 . . . . 10.0 111.433 -178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -177.06 -167.18 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.494 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.3 mt-10 -115.78 136.43 53.06 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.924 -0.398 . . . . 10.0 109.924 179.022 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -74.14 -175.35 2.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.214 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.83 -25.64 68.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.289 0.566 . . . . 10.0 110.751 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -86.12 0.51 53.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.52 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 6.36 85.14 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.284 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.494 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -62.5 104.31 0.5 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.971 0.415 . . . . 10.0 111.705 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.534 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.2 tpp85 -80.56 99.57 8.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.272 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.506 ' HZ3' ' CD ' ' A' ' 61' ' ' GLU . 91.5 mttt -83.2 114.09 21.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.969 0.414 . . . . 10.0 110.798 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -133.67 151.56 51.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.538 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 48.3 tp -119.01 109.07 15.51 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.539 -1.282 . . . . 10.0 107.539 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -133.95 156.59 47.87 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.152 0.501 . . . . 10.0 111.209 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -96.71 114.33 25.96 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.5 m -126.65 160.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.86 0.362 . . . . 10.0 110.86 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.523 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -96.53 123.02 40.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.371 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -64.07 111.23 2.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.903 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 66.2 m-80 60.12 29.32 18.91 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.064 -178.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.8 t70 69.38 16.04 8.35 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.176 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.15 -93.56 0.32 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.164 0.431 . . . . 10.0 112.164 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -80.03 122.62 83.32 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.792 0.33 . . . . 10.0 111.751 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.493 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 82.9 Cg_endo -82.16 124.38 4.3 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.894 2.396 . . . . 10.0 111.591 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -143.78 165.69 26.98 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -91.14 128.7 37.06 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.443 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t0 -139.15 130.19 26.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 9.2 tt -106.18 121.55 58.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 121.441 0.638 . . . . 10.0 109.934 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.443 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.1 mtt85 -144.88 -178.07 5.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.257 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.534 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -125.85 144.77 50.52 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.123 -0.489 . . . . 10.0 109.937 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -117.41 179.54 4.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.12 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.73 161.75 57.59 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.42 -35.28 96.19 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.312 2.008 . . . . 10.0 112.082 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -89.17 -5.47 57.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.549 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.55 37.24 16.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.898 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -94.04 -39.7 10.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.632 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -128.77 169.87 14.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.015 0.436 . . . . 10.0 110.942 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' MET . . . . . 0.407 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -149.68 172.83 14.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.343 -177.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.72 -162.83 10.19 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.959 -0.638 . . . . 10.0 112.212 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -89.11 153.45 20.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.202 0.525 . . . . 10.0 112.197 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . 0.414 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -147.32 -128.73 1.87 Allowed Glycine 0 C--N 1.331 0.282 0 N-CA-C 110.645 -0.982 . . . . 10.0 110.645 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -143.37 141.97 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 117.665 0.733 . . . . 10.0 111.13 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.11 142.25 35.22 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.254 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -125.76 126.45 44.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.582 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.9 m -79.92 171.52 15.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.25 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -55.85 -52.51 63.78 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.301 0.482 . . . . 10.0 112.301 -178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.544 ' O ' HG21 ' B' ' 64' ' ' VAL . 11.3 pt-20 -60.88 -44.59 96.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.787 0.327 . . . . 10.0 111.447 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.495 ' CD ' ' HZ3' ' A' ' 25' ' ' LYS . 52.1 mt-10 -64.39 -49.59 71.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.001 0.429 . . . . 10.0 110.848 -179.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -62.65 -39.32 93.51 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.908 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.97 -54.02 40.92 Favored Glycine 0 C--N 1.328 0.128 0 C-N-CA 121.163 -0.541 . . . . 10.0 112.961 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.544 HG21 ' O ' ' B' ' 60' ' ' GLU . 13.0 t -61.36 -39.68 83.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.161 0.505 . . . . 10.0 109.904 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.0 tp -59.87 -55.11 38.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.278 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.412 ' HB3' HD11 ' A' ' 73' ' ' LEU . 75.5 mt -58.03 -49.47 76.74 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.212 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.7 tttm -49.14 -57.18 7.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.016 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 65.5 mm-40 -70.48 -42.91 70.77 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.24 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.443 ' HB3' HD21 ' A' ' 66' ' ' LEU . 49.0 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.609 0.226 . . . . 10.0 111.609 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.95 -35.66 92.29 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . 0.404 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 10.6 t-20 -70.3 -27.26 64.25 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.951 0.405 . . . . 10.0 111.143 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 52.1 mmtt -69.0 -27.11 65.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.594 -0.276 . . . . 10.0 111.59 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 27.6 mt -89.91 -5.81 56.39 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.774 -0.37 . . . . 10.0 111.63 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . 0.404 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.2 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.663 -0.684 . . . . 10.0 110.362 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.622 0.249 . . . . 10.0 110.749 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.14 150.25 25.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.519 -0.548 . . . . 10.0 109.519 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.462 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 36.8 t70 -63.35 -41.16 98.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.846 0.355 . . . . 10.0 110.574 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 21.3 mmtm -135.79 103.56 5.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.062 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.0 tp -87.31 142.2 28.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 29.6 tptt -75.28 126.32 30.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.29 0.567 . . . . 10.0 110.744 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.3 p90 -146.34 169.71 18.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.637 -0.711 . . . . 10.0 109.154 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.471 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.0 tp10 -153.84 122.1 6.14 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.406 ' HA ' HG11 ' A' ' 30' ' ' VAL . 64.4 mt -73.23 112.97 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.078 0.466 . . . . 10.0 110.362 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -85.16 -42.76 16.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.144 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -165.48 134.23 3.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.853 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -85.71 133.25 34.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.4 mt -102.15 -75.8 0.59 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.5 -0.48 . . . . 10.0 111.9 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.471 HD13 ' O ' ' A' ' 13' ' ' LEU . 35.6 mm -131.74 137.27 55.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.568 0.581 . . . . 10.0 112.568 -177.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 p -116.31 120.68 65.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.219 -1.03 . . . . 10.0 108.219 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.3 mt -87.77 -81.44 0.24 Allowed 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.386 -0.526 . . . . 10.0 111.768 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m -178.29 -168.69 0.16 Allowed 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.622 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 14.8 mp0 -114.48 139.04 49.87 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.204 0.315 . . . . 10.0 110.924 179.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -76.1 -171.81 1.82 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.318 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.92 -26.45 68.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.311 0.577 . . . . 10.0 111.173 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -88.51 1.8 54.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.361 -0.836 . . . . 10.0 111.133 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.24 4.38 88.16 Favored Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.622 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 37.9 m0 -57.74 107.96 0.51 Allowed 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.259 -0.47 . . . . 10.0 111.911 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.9 tpp85 -86.86 104.86 16.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.889 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -91.68 117.41 29.72 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.277 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -135.55 147.86 48.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.466 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 39.4 tp -114.02 108.18 16.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.11 -0.95 . . . . 10.0 108.578 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -135.1 169.24 17.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.933 0.397 . . . . 10.0 110.832 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.438 ' HD3' ' CE1' ' A' ' 39' ' ' TYR . 10.0 ttp180 -108.86 118.01 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.406 HG11 ' HA ' ' A' ' 9' ' ' ILE . 13.9 m -127.16 161.33 34.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.724 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.471 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.8 p -96.48 123.58 40.19 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.217 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.4 109.25 1.86 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.714 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.407 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.5 m-80 62.1 23.96 14.2 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.301 0.572 . . . . 10.0 109.826 -178.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t0 66.6 23.68 10.3 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.521 -1.218 . . . . 10.0 111.088 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.47 -79.64 0.52 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.901 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -98.32 125.05 44.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.583 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.0 Cg_endo -82.21 125.88 4.74 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.801 2.334 . . . . 10.0 111.66 178.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.2 ttmm -146.38 163.92 34.08 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.438 ' CE1' ' HD3' ' A' ' 29' ' ' ARG . 7.6 m-85 -84.68 129.65 34.81 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.188 -0.301 . . . . 10.0 110.188 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.453 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -143.32 127.32 17.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.419 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -105.09 123.41 59.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 CA-C-O 121.154 0.502 . . . . 10.0 109.729 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.453 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtp85 -142.91 -179.17 6.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.389 0.614 . . . . 10.0 112.27 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.604 ' CG2' ' HB3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -124.26 135.75 53.64 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.715 -1.129 . . . . 10.0 110.404 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -122.37 165.34 16.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.721 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -67.98 152.53 96.34 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.121 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.19 -35.88 95.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.85 2.367 . . . . 10.0 113.109 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.48 -4.92 59.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.949 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 63.0 28.94 16.43 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.833 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -79.18 -35.41 41.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.705 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.3 mmmm -141.08 174.55 10.41 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.328 0.585 . . . . 10.0 111.63 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.57 168.06 19.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.888 -1.051 . . . . 10.0 110.889 -178.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.38 -171.77 12.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.056 -0.593 . . . . 10.0 112.144 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.7 mttp -90.97 151.62 21.01 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.154 -0.615 . . . . 10.0 111.838 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.07 -123.48 1.44 Allowed Glycine 0 C--N 1.333 0.398 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.6 141.07 15.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 121.366 0.603 . . . . 10.0 111.751 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.72 143.41 30.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.75 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.5 mt -119.77 128.4 53.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.378 -0.373 . . . . 10.0 110.258 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.413 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 1.8 m -76.16 162.93 27.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -56.64 -48.66 77.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.024 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -64.26 -43.39 95.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.004 0.431 . . . . 10.0 110.717 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.416 ' CD ' ' HZ3' ' B' ' 25' ' ' LYS . 93.8 mt-10 -61.15 -51.89 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.289 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.41 -36.75 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.65 -52.49 52.16 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 121.201 -0.523 . . . . 10.0 112.032 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.1 t -64.63 -41.96 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.957 0.408 . . . . 10.0 110.075 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 13.0 tp -56.46 -52.86 63.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.443 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.477 ' HB3' ' CD1' ' B' ' 73' ' ' LEU . 19.0 mt -62.07 -47.04 86.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.917 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -50.48 -52.91 33.93 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.558 0.536 . . . . 10.0 111.115 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.653 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 7.5 mm-40 -70.35 -51.51 29.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.649 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.442 ' HB3' HD22 ' B' ' 66' ' ' LEU . 72.8 mt -55.37 -45.89 76.53 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -178.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.48 -39.27 97.08 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.688 -0.768 . . . . 10.0 111.34 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -72.89 -26.77 61.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.82 0.343 . . . . 10.0 110.882 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.653 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 40.5 mmtt -67.32 -30.21 69.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.548 -0.296 . . . . 10.0 110.479 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.0 mt -77.34 -22.2 52.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.274 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.629 -0.7 . . . . 10.0 110.389 -179.714 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.965 0.412 . . . . 10.0 110.315 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.39 150.77 23.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.22 -0.446 . . . . 10.0 109.817 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.452 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 29.0 t70 -63.79 -41.34 97.95 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.116 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.452 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 31.1 mmtm -134.35 104.82 6.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.952 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 23.7 tp -88.2 141.4 28.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 28.4 tptt -75.81 124.66 27.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.418 0.628 . . . . 10.0 110.66 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -144.58 168.37 20.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.22 -0.9 . . . . 10.0 108.839 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.46 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 12.7 tp10 -151.68 119.71 6.25 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 63.8 mt -70.86 110.79 4.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.066 0.46 . . . . 10.0 110.275 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 34.7 mm -83.44 -43.45 18.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.278 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -164.08 132.92 3.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.953 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -83.9 135.04 34.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 62.7 mt -105.51 -74.74 0.64 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.547 -0.461 . . . . 10.0 111.845 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.417 HD12 HG21 ' B' ' 14' ' ' ILE . 17.5 mm -130.77 137.23 56.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -117.56 118.14 57.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.168 -1.049 . . . . 10.0 108.168 177.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -86.68 -81.69 0.22 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.441 -0.504 . . . . 10.0 111.716 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.68 -168.83 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.835 0.454 . . . . 10.0 109.81 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.626 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 15.7 mp0 -113.59 141.53 47.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.517 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -76.98 -169.41 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.764 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.21 -20.71 64.86 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.142 0.496 . . . . 10.0 111.041 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -91.51 1.32 57.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.694 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.46 3.01 84.63 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.006 -0.838 . . . . 10.0 111.006 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.626 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 38.1 m0 -57.07 108.96 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.315 -0.443 . . . . 10.0 112.152 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.2 tpp85 -87.5 105.52 17.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.132 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.416 ' HZ3' ' CD ' ' A' ' 61' ' ' GLU . 70.2 mttt -91.82 116.47 28.93 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.945 0.402 . . . . 10.0 110.465 179.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -134.51 146.87 50.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.069 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.537 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 38.4 tp -113.73 108.41 17.07 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -134.89 169.1 17.9 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.856 0.36 . . . . 10.0 110.736 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.528 ' HD3' ' CE1' ' B' ' 39' ' ' TYR . 14.3 ttp180 -108.94 115.63 30.44 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.5 m -125.14 161.74 28.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.751 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.2 p -96.56 123.82 40.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.319 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.02 110.06 2.01 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.292 -0.632 . . . . 10.0 109.292 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.441 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.44 26.95 16.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.479 0.656 . . . . 10.0 110.039 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 39.2 t0 63.27 25.46 14.74 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.623 -1.171 . . . . 10.0 110.839 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -78.85 0.56 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.767 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -99.08 122.59 51.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-O 120.697 0.284 . . . . 10.0 111.666 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.485 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.5 Cg_endo -80.14 126.97 6.56 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.922 2.414 . . . . 10.0 112.027 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -148.1 165.27 31.34 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . 0.528 ' CE1' ' HD3' ' B' ' 29' ' ' ARG . 7.0 m-85 -85.64 128.78 34.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.268 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.431 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 11.3 t0 -143.04 127.46 17.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . 0.407 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.9 tt -105.47 123.28 59.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.431 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 4.8 mtp85 -143.12 -179.22 6.25 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.407 0.622 . . . . 10.0 112.373 -177.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.599 ' CG2' ' HB3' ' B' ' 23' ' ' TRP . 0.2 OUTLIER -123.73 136.72 54.61 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.263 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -122.5 166.39 14.86 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.624 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -69.69 152.52 96.14 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 10.0 109.953 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.02 -40.46 81.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.926 2.418 . . . . 10.0 113.0 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -84.98 -5.26 59.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 10.0 110.859 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 66.27 24.3 10.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.375 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -72.02 -38.93 69.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.823 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -138.5 174.55 10.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.467 0.651 . . . . 10.0 111.853 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.49 166.98 21.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.671 -1.15 . . . . 10.0 110.631 -178.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.2 -169.28 12.39 Favored Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.126 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -92.33 146.92 23.33 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.169 -0.606 . . . . 10.0 111.914 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.22 -125.31 2.1 Favored Glycine 0 N--CA 1.453 -0.221 0 N-CA-C 110.7 -0.96 . . . . 10.0 110.7 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.1 tt -151.93 139.47 13.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 117.684 0.742 . . . . 10.0 111.55 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.54 141.47 31.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.887 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 76.5 mt -118.45 129.32 55.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.486 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' SER . . . . . 0.406 ' HG ' ' CD ' ' B' ' 61' ' ' GLU . 3.7 m -73.67 164.58 26.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -60.08 -48.21 82.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.467 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.403 ' O ' HG21 ' B' ' 64' ' ' VAL . 14.7 pt-20 -63.53 -41.0 98.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.041 0.448 . . . . 10.0 110.739 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.406 ' CD ' ' HG ' ' B' ' 58' ' ' SER . 88.1 mt-10 -63.49 -53.22 55.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.918 -179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -61.08 -36.78 80.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.291 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.51 -52.7 50.97 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.204 -0.522 . . . . 10.0 112.102 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.403 HG21 ' O ' ' B' ' 60' ' ' GLU . 60.5 t -64.02 -43.22 97.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.043 0.449 . . . . 10.0 109.887 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.52 -52.7 62.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.569 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.442 HD22 ' HB3' ' A' ' 69' ' ' LEU . 44.0 mt -60.6 -49.57 77.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.462 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -50.09 -54.07 22.97 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 123.523 0.515 . . . . 10.0 111.363 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.625 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 6.3 mm-40 -69.19 -52.98 22.45 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.655 -178.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 61.0 mt -56.36 -44.57 80.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -178.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.98 -38.62 95.79 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.972 -0.633 . . . . 10.0 111.644 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . 0.461 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.1 t-20 -75.67 -23.07 56.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.806 0.336 . . . . 10.0 111.013 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.625 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.1 mmtt -69.83 -26.07 64.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.507 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.477 ' CD1' ' HB3' ' A' ' 66' ' ' LEU . 22.0 mt -84.85 -12.57 53.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.974 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . 0.461 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.9 mt-10 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.619 -0.705 . . . . 10.0 110.246 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 mmt . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.83 0.348 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.0 171.86 7.25 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.482 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 34.3 t70 -71.15 -50.61 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.9 -0.408 . . . . 10.0 109.9 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.482 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 45.8 mmtm -140.66 120.86 13.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.668 178.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.3 tp -92.87 138.74 31.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.44 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -72.03 128.71 36.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.459 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -156.11 163.17 39.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.47 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 6.7 tp10 -145.64 134.57 22.52 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.262 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.3 mt -84.3 110.36 18.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.402 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 41.2 mm -78.52 -47.62 23.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.763 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -162.32 134.62 5.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.905 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.62 137.26 37.76 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.521 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 72.2 mt -106.32 -75.94 0.62 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.157 -0.617 . . . . 10.0 111.44 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.473 HD13 ' O ' ' A' ' 13' ' ' LEU . 26.5 mm -132.93 139.35 49.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -177.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -117.04 125.72 74.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 107.805 -1.183 . . . . 10.0 107.805 177.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.461 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.8 mt -95.66 -81.12 0.41 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.984 -0.686 . . . . 10.0 112.033 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 m -176.35 -165.18 0.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.553 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 17.9 mt-10 -117.43 143.73 45.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.855 0.36 . . . . 10.0 110.53 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -80.21 -176.68 5.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.678 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.57 -21.43 66.34 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.607 0.718 . . . . 10.0 110.711 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -87.23 -6.31 58.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.087 -0.961 . . . . 10.0 110.556 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.23 3.46 72.6 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.076 -0.81 . . . . 10.0 111.076 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.553 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.4 m0 -60.77 108.15 0.81 Allowed 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.742 -0.229 . . . . 10.0 111.345 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.467 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.8 tpp85 -84.05 100.26 10.98 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 80.0 mttt -84.51 114.15 21.74 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.75 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -134.06 147.73 50.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.875 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 37.2 tp -115.34 110.56 19.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.232 -0.895 . . . . 10.0 108.623 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.57 159.31 40.84 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.051 0.453 . . . . 10.0 111.304 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -95.75 113.94 25.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.9 m -126.85 159.33 36.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.94 0.4 . . . . 10.0 110.868 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.47 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.3 p -96.8 123.72 40.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.471 179.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.5 m0 -63.62 108.64 1.44 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.489 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.44 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.3 m-80 59.61 28.93 18.45 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.107 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 63.67 26.9 14.7 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 114.927 -1.033 . . . . 10.0 111.229 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.88 -70.49 0.79 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.646 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -95.12 112.83 59.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.573 -0.285 . . . . 10.0 111.726 -178.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 6.3 Cg_exo -77.06 120.38 5.39 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.018 2.479 . . . . 10.0 110.909 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.415 ' HE3' ' CG2' ' A' ' 56' ' ' THR . 19.5 ttpt -148.89 166.55 28.23 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.733 -0.387 . . . . 10.0 110.61 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -90.26 134.48 34.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.64 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.416 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.57 132.97 18.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.9 tt -109.78 122.84 65.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 121.321 0.581 . . . . 10.0 109.802 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.416 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.2 mtt85 -144.9 179.73 7.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.197 -178.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.476 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -125.1 144.21 50.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.256 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -117.78 171.03 8.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.798 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 m -70.28 157.55 89.65 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.92 -29.22 88.91 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.248 1.965 . . . . 10.0 112.016 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -94.34 -1.07 54.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.811 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 61.78 27.01 16.47 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.127 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -76.81 -36.19 57.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.417 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -139.25 174.66 10.28 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.52 0.676 . . . . 10.0 112.304 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.93 172.93 12.28 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.337 -1.301 . . . . 10.0 110.302 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -143.09 -167.38 11.53 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 120.852 -0.69 . . . . 10.0 111.969 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -93.36 147.53 22.86 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.029 -0.689 . . . . 10.0 112.241 -179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.24 -117.89 1.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.576 -1.01 . . . . 10.0 110.576 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.29 141.27 15.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 117.348 0.574 . . . . 10.0 111.031 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.415 ' CG2' ' HE3' ' A' ' 38' ' ' LYS . 1.2 m -101.85 141.32 34.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.595 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.5 mt -119.28 129.41 54.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.164 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 t -79.5 168.35 19.56 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.854 -0.425 . . . . 10.0 109.854 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -58.39 -50.5 73.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.075 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.18 -41.91 98.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.041 0.448 . . . . 10.0 110.886 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.19 -54.02 44.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.016 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.605 ' CE2' HD13 ' A' ' 66' ' ' LEU . 33.1 t80 -56.78 -43.16 80.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.352 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.28 -52.5 52.89 Favored Glycine 0 CA--C 1.519 0.292 0 C-N-CA 121.327 -0.463 . . . . 10.0 113.155 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.73 -42.56 95.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.861 0.362 . . . . 10.0 110.482 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.44 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.4 tp -56.25 -51.35 68.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.804 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.605 HD13 ' CE2' ' A' ' 62' ' ' PHE . 21.5 mt -62.67 -46.61 87.37 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.467 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.9 tttm -50.83 -54.46 23.58 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.705 0.628 . . . . 10.0 111.352 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.517 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 9.2 mm-40 -66.9 -51.23 57.93 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.801 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 81.8 mt -57.5 -45.84 84.46 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.54 -39.37 97.56 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.884 -0.674 . . . . 10.0 111.767 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -68.6 -27.47 66.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.625 0.25 . . . . 10.0 111.142 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 75.3 mmtt -69.59 -28.71 66.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.866 0.365 . . . . 10.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 32.2 mt -89.67 -2.84 58.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.323 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.656 -179.608 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 23.7 mmt . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.834 0.35 . . . . 10.0 110.144 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.31 167.55 9.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.065 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.447 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 38.0 t70 -66.79 -54.33 23.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.141 0.496 . . . . 10.0 110.026 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.447 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 42.9 mmtm -139.44 118.07 12.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.349 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.8 tp -89.03 138.65 31.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.662 0.268 . . . . 10.0 110.494 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.413 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.0 tppt? -72.1 128.34 35.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.591 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -156.49 163.57 39.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.141 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -147.29 136.35 22.34 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.747 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -84.54 111.76 20.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.678 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.51 -45.33 23.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.176 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -165.47 131.53 2.66 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.478 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.4 139.95 41.15 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.527 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 70.0 mt -109.92 -73.69 0.68 Allowed 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.203 -0.599 . . . . 10.0 111.936 -178.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.516 HD11 ' CB ' ' A' ' 68' ' ' GLU . 16.4 mm -132.49 138.01 53.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -117.48 122.43 69.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 49.0 mt -93.25 -81.31 0.36 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.274 -0.57 . . . . 10.0 112.32 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.4 m -176.22 -166.45 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.556 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 48.6 mt-10 -117.91 140.24 49.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.684 0.278 . . . . 10.0 110.526 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -75.83 -176.01 3.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.057 -0.519 . . . . 10.0 109.927 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.9 -16.84 64.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.416 0.627 . . . . 10.0 110.785 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -91.84 -4.79 54.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.375 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.7 2.07 73.0 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.621 -0.8 . . . . 10.0 111.412 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.556 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.0 m0 -59.45 107.05 0.52 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 120.805 0.335 . . . . 10.0 111.537 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.453 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.6 tpp85 -82.96 100.2 10.27 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.441 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 79.3 mttt -84.7 114.05 21.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.883 -179.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -135.22 147.4 49.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.681 . . . . 10.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.527 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 35.0 tp -114.4 110.76 20.38 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.258 -0.883 . . . . 10.0 108.906 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.73 158.94 42.03 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.038 0.446 . . . . 10.0 111.069 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -95.36 113.71 25.41 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 m -126.44 161.16 33.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.901 0.382 . . . . 10.0 110.778 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -98.52 124.24 43.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.565 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -64.08 108.13 1.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.573 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.413 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.07 29.5 19.06 Favored 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 123.783 0.677 . . . . 10.0 109.896 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 27.9 t70 63.19 22.11 13.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 114.615 -1.175 . . . . 10.0 111.299 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.14 -66.6 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.035 -0.415 . . . . 10.0 111.785 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.44 112.13 61.59 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 56.5 Cg_endo -77.18 120.19 5.27 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.219 1.946 . . . . 10.0 110.872 178.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 16.9 ttpt -147.81 170.39 17.72 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.014 -0.274 . . . . 10.0 110.509 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -93.55 133.52 36.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.673 -0.24 . . . . 10.0 110.686 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.408 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -147.11 132.2 18.28 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 11.7 tt -108.08 122.72 62.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.275 0.56 . . . . 10.0 109.907 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.408 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.6 mtt85 -145.33 177.15 9.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.377 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.453 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -122.14 144.09 49.15 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.29 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 38.2 m95 -118.01 171.66 7.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.71 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.1 m -70.8 158.06 88.85 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -59.61 -29.5 90.0 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.179 1.919 . . . . 10.0 111.691 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.96 -3.29 51.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.869 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 61.49 29.96 18.6 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.744 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.29 -34.6 31.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.166 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mmtm -137.56 174.28 10.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.321 0.581 . . . . 10.0 112.113 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.72 172.4 12.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.085 -178.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -141.95 -164.23 9.96 Favored Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.631 -0.795 . . . . 10.0 112.195 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -96.8 143.44 27.72 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.095 -0.65 . . . . 10.0 112.139 -179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -136.55 -118.49 1.76 Allowed Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 110.338 -1.105 . . . . 10.0 110.338 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -152.4 141.38 14.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 117.59 0.695 . . . . 10.0 110.926 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -100.47 142.29 32.14 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.673 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 71.6 mt -120.41 128.78 53.52 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.19 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -77.36 169.23 18.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.29 -48.43 81.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.632 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.595 ' O ' HG21 ' B' ' 64' ' ' VAL . 10.6 pt-20 -62.37 -44.3 96.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.055 0.455 . . . . 10.0 110.486 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -61.31 -54.11 48.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.614 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.405 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -58.05 -40.47 81.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.687 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.55 -51.55 58.15 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 116.024 -0.535 . . . . 10.0 112.552 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.595 HG21 ' O ' ' B' ' 60' ' ' GLU . 15.1 t -65.74 -44.67 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 120.801 0.334 . . . . 10.0 110.387 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.0 -51.75 65.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.919 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 95.9 mt -60.48 -51.1 70.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.144 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.07 -57.61 5.58 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.758 0.661 . . . . 10.0 112.142 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 9.3 mm-40 -65.85 -50.39 64.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.068 -0.514 . . . . 10.0 112.146 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.452 ' HB3' HD22 ' A' ' 66' ' ' LEU . 78.6 mt -59.59 -44.97 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -178.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.69 -37.45 94.81 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.188 -0.529 . . . . 10.0 111.921 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -71.94 -27.34 62.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.818 0.342 . . . . 10.0 111.147 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.2 mmtt -66.07 -34.17 77.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.646 0.26 . . . . 10.0 111.051 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 23.6 mt -90.64 8.81 32.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.606 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.242 -0.885 . . . . 10.0 110.575 -180.0 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 CA-C-O 120.757 0.313 . . . . 10.0 110.895 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.3 158.2 16.78 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.076 -0.342 . . . . 10.0 110.076 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -61.53 -50.06 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 10.0 110.392 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -136.47 100.45 4.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.48 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.9 tp -75.61 140.52 42.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.442 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.8 tppt? -75.75 136.14 40.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.91 0.386 . . . . 10.0 110.937 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -158.92 174.85 14.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.506 -0.553 . . . . 10.0 109.506 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.449 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.0 tp10 -156.58 129.13 7.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.732 -0.469 . . . . 10.0 109.732 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.434 ' HA ' HG11 ' A' ' 30' ' ' VAL . 61.1 mt -80.75 119.02 29.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.945 0.402 . . . . 10.0 110.625 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.9 mm -90.33 -48.63 14.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.287 0.565 . . . . 10.0 110.204 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -162.38 128.43 3.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.865 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -74.72 144.65 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.844 -0.799 . . . . 10.0 108.844 178.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 80.4 mt -114.1 -72.98 0.67 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.579 -0.448 . . . . 10.0 112.096 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.409 HD13 ' O ' ' A' ' 13' ' ' LEU . 28.3 mm -131.37 140.58 48.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.472 . . . . 10.0 112.196 -177.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.1 120.07 57.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 177.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.7 mt -89.3 -80.27 0.3 Allowed 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.68 -0.408 . . . . 10.0 111.837 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 m -179.04 -166.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.679 . . . . 10.0 109.168 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.498 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.6 mp0 -112.91 144.04 43.16 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.273 0.358 . . . . 10.0 110.366 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -81.57 -173.78 4.6 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -21.74 66.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.674 0.749 . . . . 10.0 110.438 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -87.71 -5.61 58.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.059 -0.973 . . . . 10.0 110.534 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.11 4.26 74.86 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.692 -0.765 . . . . 10.0 111.303 -178.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.498 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -63.14 105.15 0.66 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.817 0.341 . . . . 10.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.521 ' O ' ' HA ' ' A' ' 43' ' ' THR . 8.1 tpp85 -83.71 100.13 10.69 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.446 178.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.481 ' HZ2' ' CD ' ' B' ' 61' ' ' GLU . 88.8 mttt -82.94 114.95 21.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.112 0.482 . . . . 10.0 110.998 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -131.85 147.89 52.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.517 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.498 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 33.9 tp -118.19 109.5 16.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -133.25 161.76 33.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.026 0.441 . . . . 10.0 111.283 -178.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -96.27 113.96 25.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.153 -1.055 . . . . 10.0 108.153 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.434 HG11 ' HA ' ' A' ' 9' ' ' ILE . 16.8 m -129.75 158.53 42.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.698 0.285 . . . . 10.0 111.035 -178.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.504 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -95.92 124.85 40.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.001 0.429 . . . . 10.0 110.507 179.098 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -64.52 112.46 3.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.912 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.442 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 57.16 30.85 19.02 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.75 0.656 . . . . 10.0 110.579 -178.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.2 t70 63.02 30.22 16.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 114.708 -1.133 . . . . 10.0 111.096 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.17 -83.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.03 -0.419 . . . . 10.0 111.347 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -96.7 125.12 48.05 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.683 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.504 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.1 Cg_endo -77.93 132.7 11.93 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.726 2.284 . . . . 10.0 111.489 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -151.27 169.12 22.71 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -94.38 123.9 38.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.631 0.253 . . . . 10.0 110.406 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.415 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -137.27 129.96 30.16 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.8 tt -107.6 123.02 62.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.199 0.523 . . . . 10.0 109.896 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.415 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.1 mtt85 -145.23 179.44 7.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.343 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -124.3 145.55 49.33 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.953 179.426 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.427 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 44.5 m95 -117.52 170.85 8.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.07 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -69.98 158.22 87.84 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.76 -34.95 92.53 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.605 2.204 . . . . 10.0 112.541 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -91.21 -0.52 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.596 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.2 30.17 19.14 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.786 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -84.46 -33.76 23.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.949 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -136.42 174.68 10.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.537 0.685 . . . . 10.0 111.819 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.427 ' HB3' ' CE3' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -141.27 173.25 11.66 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.702 -177.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.58 -157.36 7.25 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.605 -0.807 . . . . 10.0 112.412 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mttm -96.14 151.01 19.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.496 -0.414 . . . . 10.0 111.934 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.26 -121.16 1.25 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.5 tt -152.75 141.79 14.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.407 0.603 . . . . 10.0 111.229 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.9 140.82 38.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.707 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.8 mt -121.15 135.22 55.2 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.398 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 m -76.46 164.31 26.1 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.907 -0.405 . . . . 10.0 109.907 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -58.97 -46.98 86.75 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.98 -44.75 94.29 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.136 0.493 . . . . 10.0 110.315 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.435 ' HB3' HD12 ' B' ' 16' ' ' LEU . 80.4 mt-10 -61.4 -52.05 66.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.746 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.621 ' CE2' HD12 ' A' ' 66' ' ' LEU . 28.0 t80 -56.77 -44.29 81.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.311 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.3 -47.73 89.64 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.344 -0.455 . . . . 10.0 112.72 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 92.9 t -68.45 -43.89 83.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.4 tp -56.35 -49.52 74.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.792 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.621 HD12 ' CE2' ' A' ' 62' ' ' PHE . 19.0 mt -64.27 -44.66 91.02 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 121.16 -0.216 . . . . 10.0 111.462 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.2 tttm -54.67 -50.3 68.54 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.477 0.486 . . . . 10.0 110.848 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.538 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 25.2 mm-40 -70.5 -48.76 54.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.425 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 47.8 mt -59.04 -44.2 91.76 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.06 -38.42 95.97 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.411 -0.9 . . . . 10.0 110.996 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -70.09 -25.25 63.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.35 -0.425 . . . . 10.0 110.941 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 29.5 mmmt -67.97 -28.84 67.79 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.039 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 28.7 mt -88.12 -7.8 56.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.876 0.37 . . . . 10.0 110.814 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.523 -0.751 . . . . 10.0 110.172 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 120.767 0.317 . . . . 10.0 110.5 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.48 155.93 19.52 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -60.69 -49.2 78.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 10.0 110.47 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -136.29 101.8 4.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 26.2 tp -77.74 139.45 39.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.7 tppt? -75.29 136.43 40.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.111 0.481 . . . . 10.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -160.47 171.73 18.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.31 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.401 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 10.5 tp10 -153.27 130.34 11.09 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.39 116.97 24.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.114 0.483 . . . . 10.0 110.805 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -88.32 -44.54 15.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.554 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -166.94 130.41 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.98 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.83 141.14 40.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 56.4 mt -113.16 -73.64 0.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.492 -0.483 . . . . 10.0 112.056 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.44 HD13 ' CB ' ' A' ' 68' ' ' GLU . 17.0 mm -128.84 139.43 51.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.1 0.476 . . . . 10.0 112.032 -177.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.8 p -124.44 120.69 59.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . 0.435 HD12 ' HB3' ' A' ' 61' ' ' GLU . 29.0 mt -91.11 -81.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.875 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -179.16 -166.35 0.09 Allowed 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -113.03 140.23 48.01 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.882 0.372 . . . . 10.0 110.829 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -77.31 -174.63 3.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.177 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.18 -18.79 65.57 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.381 0.61 . . . . 10.0 110.599 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -90.37 -5.72 55.85 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.424 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.58 69.2 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 111.247 -0.741 . . . . 10.0 111.247 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.501 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -64.48 104.92 0.85 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.68 0.276 . . . . 10.0 111.373 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.7 tpp85 -83.12 101.34 11.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.448 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.459 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 92.4 mttt -84.29 116.81 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.2 0.524 . . . . 10.0 111.073 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -134.12 146.73 50.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.364 -0.835 . . . . 10.0 110.659 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.446 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 39.1 tp -116.63 111.25 19.6 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.2 159.27 42.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.086 0.469 . . . . 10.0 111.296 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -93.38 114.25 26.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 m -130.42 157.82 42.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.921 0.391 . . . . 10.0 111.036 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.509 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 0.1 OUTLIER -95.23 124.59 39.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.585 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -64.17 110.91 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.01 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.0 m-80 58.84 30.03 19.56 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 123.859 0.724 . . . . 10.0 110.473 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.8 t70 64.84 28.02 12.84 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.676 -1.147 . . . . 10.0 111.034 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.15 -83.28 0.59 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.018 -0.426 . . . . 10.0 111.746 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -96.03 122.48 58.14 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.658 -0.246 . . . . 10.0 111.509 -178.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.509 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.69 129.55 10.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.976 2.451 . . . . 10.0 111.866 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -148.13 169.79 19.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -94.99 122.53 37.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.404 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.409 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -136.48 131.79 34.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 10.4 tt -108.92 122.44 63.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.207 0.527 . . . . 10.0 110.02 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.409 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.3 mtt85 -144.89 -179.71 6.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.44 -177.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.539 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -125.25 145.91 49.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.066 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 45.9 m95 -117.84 171.25 8.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.182 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.3 m -70.34 157.93 88.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.9 -0.407 . . . . 10.0 109.9 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -56.07 -32.05 85.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.601 2.201 . . . . 10.0 112.728 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.94 -3.55 51.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.099 0.476 . . . . 10.0 110.263 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 31.82 12.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.973 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -86.34 -30.86 21.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.032 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -137.91 174.41 10.6 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.401 0.62 . . . . 10.0 111.893 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.38 173.07 11.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.883 -1.053 . . . . 10.0 110.324 -177.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.18 -157.24 7.39 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.226 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.42 147.13 26.7 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.033 -0.686 . . . . 10.0 111.967 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.98 -119.48 1.64 Allowed Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 110.724 -0.95 . . . . 10.0 110.724 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.5 tt -152.84 143.23 15.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 117.308 0.554 . . . . 10.0 111.005 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.46 140.46 38.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.85 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 48.2 mt -121.27 135.0 55.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.497 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.42 164.44 25.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.15 -0.477 . . . . 10.0 109.866 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -60.32 -44.86 95.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.43 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.488 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.1 pt-20 -63.35 -41.52 98.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.117 0.484 . . . . 10.0 110.637 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.481 ' CD ' ' HZ2' ' A' ' 25' ' ' LYS . 79.1 mt-10 -64.07 -50.54 67.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.246 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.465 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -59.22 -41.41 88.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.406 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.23 -50.89 62.99 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.088 -0.577 . . . . 10.0 112.334 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.488 HG23 ' O ' ' B' ' 60' ' ' GLU . 47.6 t -66.12 -45.83 89.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.058 0.456 . . . . 10.0 110.413 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.5 tp -55.3 -49.72 71.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.629 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 76.9 mt -61.77 -47.47 85.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.943 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -54.4 -52.4 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.588 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 7.5 mm-40 -68.82 -50.08 53.11 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.551 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.468 ' HB3' HD23 ' A' ' 66' ' ' LEU . 46.9 mt -60.09 -44.45 94.78 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.674 0.25 . . . . 10.0 111.674 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.07 -35.76 91.93 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.306 -0.718 . . . . 10.0 111.306 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -75.04 -25.19 58.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.87 0.367 . . . . 10.0 110.756 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 23.5 mmmt -64.9 -30.82 71.84 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.179 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 26.7 mt -89.29 0.42 56.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.186 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.691 -0.671 . . . . 10.0 109.358 179.158 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 110.035 -0.358 . . . . 10.0 110.035 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.45 165.12 11.99 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.402 ' OD1' ' HG2' ' A' ' 4' ' ' LYS . 13.3 t70 -67.34 -58.71 4.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.156 0.503 . . . . 10.0 110.152 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.402 ' HG2' ' OD1' ' A' ' 3' ' ' ASP . 37.3 mmtm -132.79 104.67 6.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.757 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.39 141.18 41.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.774 0.321 . . . . 10.0 110.636 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -70.99 130.82 42.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.436 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.7 p90 -157.03 160.84 39.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.767 0.318 . . . . 10.0 110.934 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.464 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.7 tp10 -147.26 126.28 12.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.568 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.2 mt -82.69 106.12 13.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.15 0.5 . . . . 10.0 110.237 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.4 mm -76.49 -41.94 35.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.766 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -166.84 126.91 1.53 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.862 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -75.5 143.12 42.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 77.0 mt -110.01 -75.87 0.62 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.352 -0.539 . . . . 10.0 111.794 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.402 HD11 ' HB3' ' B' ' 68' ' ' GLU . 29.9 mm -128.49 137.34 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.53 . . . . 10.0 112.006 -177.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -119.83 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 177.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.0 mt -92.28 -80.92 0.35 Allowed 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.568 -0.453 . . . . 10.0 111.862 -178.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.84 -168.72 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.525 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -110.34 147.76 33.29 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -83.27 -168.83 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.77 -21.45 65.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.548 0.69 . . . . 10.0 110.317 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -91.5 1.06 57.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.95 -1.023 . . . . 10.0 110.718 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.74 4.77 88.68 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.58 -0.819 . . . . 10.0 111.395 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.525 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.24 103.28 0.37 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.89 0.376 . . . . 10.0 110.994 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 43' ' ' THR . 11.3 tpp85 -83.8 100.69 11.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.571 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.471 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 93.0 mttt -83.4 115.12 21.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.066 0.46 . . . . 10.0 110.828 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -131.4 143.54 50.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.47 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.515 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 40.0 tp -112.43 108.29 17.39 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.157 -1.053 . . . . 10.0 108.157 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -131.54 160.64 34.66 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 10.0 111.213 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -97.11 113.73 25.33 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.501 -0.925 . . . . 10.0 108.501 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.5 m -127.46 157.0 39.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 120.928 0.394 . . . . 10.0 110.767 -179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.501 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -95.95 125.81 40.76 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.176 178.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -64.62 110.21 2.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.959 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 60.66 27.53 17.25 Favored 'General case' 0 C--O 1.235 0.294 0 O-C-N 124.061 0.851 . . . . 10.0 110.624 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.6 t70 68.41 23.63 7.47 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.91 -1.041 . . . . 10.0 110.709 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.99 -84.67 0.54 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.102 -0.373 . . . . 10.0 111.666 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -91.63 123.27 64.05 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.501 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 62.8 Cg_endo -80.79 124.13 4.97 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.766 2.311 . . . . 10.0 111.808 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.407 ' HG2' ' H ' ' A' ' 39' ' ' TYR . 20.0 ttmm -143.08 170.03 16.47 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.407 ' H ' ' HG2' ' A' ' 38' ' ' LYS . 5.1 m-85 -96.1 126.57 41.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.684 0.278 . . . . 10.0 110.466 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.427 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -140.4 130.06 24.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.411 HD13 HG23 ' A' ' 41' ' ' ILE . 11.5 tt -106.55 124.32 61.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.354 0.597 . . . . 10.0 110.019 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.427 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.7 mtt85 -144.66 176.75 9.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.214 -177.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -123.63 142.11 51.36 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.796 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -117.58 170.66 8.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.932 -0.576 . . . . 10.0 109.616 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.11 159.08 73.59 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -57.81 -31.63 92.84 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.237 1.958 . . . . 10.0 111.773 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -91.57 -1.94 57.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.412 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 60.0 31.41 20.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.804 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -83.8 -33.14 25.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.165 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -135.74 174.88 10.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.366 0.603 . . . . 10.0 111.558 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.33 167.72 21.44 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.818 -1.083 . . . . 10.0 110.769 -177.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.11 -162.4 9.73 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.16 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -95.59 151.01 19.71 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.245 -0.562 . . . . 10.0 111.797 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.13 -125.43 1.61 Allowed Glycine 0 C--N 1.331 0.262 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.365 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.0 143.43 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.518 0.659 . . . . 10.0 111.259 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.92 140.06 39.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.572 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.4 mt -119.78 134.22 55.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.27 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.5 m -79.17 169.55 17.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.325 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.44 -49.8 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.707 0.262 . . . . 10.0 111.707 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -60.98 -43.47 98.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.548 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -61.03 -50.77 71.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.586 -0.733 . . . . 10.0 110.441 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.709 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.3 t80 -56.46 -45.84 80.66 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.239 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.89 -51.47 58.4 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.296 -0.478 . . . . 10.0 112.901 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.2 t -64.96 -42.69 95.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 10.0 110.664 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.62 -51.83 67.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.807 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.709 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -62.84 -45.47 92.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.47 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -52.65 -51.37 60.42 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.208 0.528 . . . . 10.0 111.246 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 9.6 mm-40 -71.41 -47.49 55.66 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.809 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HB3' HD23 ' B' ' 66' ' ' LEU . 48.4 mt -58.4 -44.46 88.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.574 0.226 . . . . 10.0 111.604 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.9 -40.41 99.24 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.577 -0.82 . . . . 10.0 111.143 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -68.53 -26.54 65.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.326 . . . . 10.0 110.728 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 68.3 mmtt -69.66 -27.04 64.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.022 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 35.7 mt -82.37 -25.46 33.78 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.073 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.618 -0.706 . . . . 10.0 110.465 -179.713 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.331 . . . . 10.0 110.223 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.36 171.33 8.64 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.426 ' OD1' ' HG2' ' B' ' 4' ' ' LYS . 13.1 t70 -74.22 -56.6 4.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.03 0.443 . . . . 10.0 110.059 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.426 ' HG2' ' OD1' ' B' ' 3' ' ' ASP . 41.9 mmtm -134.08 101.65 5.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.76 -0.654 . . . . 10.0 109.372 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 37.1 tp -74.56 137.79 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.151 -0.314 . . . . 10.0 110.151 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -70.33 128.56 36.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.785 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -153.5 163.35 40.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.392 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.455 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 11.5 tp10 -150.16 122.9 8.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . 0.408 ' HA ' HG11 ' B' ' 30' ' ' VAL . 56.8 mt -79.07 109.9 14.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.144 0.497 . . . . 10.0 110.555 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.9 mm -79.13 -41.75 23.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.616 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -166.61 125.47 1.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.49 139.41 42.19 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 50.0 mt -108.46 -73.78 0.68 Allowed 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.385 -0.526 . . . . 10.0 112.294 -177.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.464 HD13 ' CB ' ' A' ' 68' ' ' GLU . 14.5 mm -128.01 132.22 68.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -177.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.8 p -115.77 122.37 69.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 177.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.1 mt -93.51 -80.83 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.754 -0.379 . . . . 10.0 111.84 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.8 m 178.94 -169.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.473 -0.565 . . . . 10.0 109.473 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.27 148.07 30.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.582 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -84.28 -171.92 3.88 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -18.69 65.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.383 0.611 . . . . 10.0 110.699 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -92.61 -3.32 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.606 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.82 4.13 76.03 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.418 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.508 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.2 m0 -62.06 104.01 0.43 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.747 0.308 . . . . 10.0 111.02 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.497 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.5 tpp85 -84.45 100.75 11.53 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 179.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.464 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 92.4 mttt -82.25 116.24 21.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.016 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -132.56 141.3 48.65 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.744 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.452 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 40.8 tp -110.79 108.11 17.84 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -131.78 159.14 39.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.936 0.398 . . . . 10.0 111.385 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -94.8 113.58 25.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.408 HG11 ' HA ' ' B' ' 9' ' ' ILE . 14.7 m -126.88 157.79 37.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.884 0.373 . . . . 10.0 110.773 -179.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.1 p -97.26 125.5 41.86 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.32 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -64.53 110.4 2.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.932 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 59.24 30.09 19.77 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.504 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 34.0 t70 66.48 20.85 10.87 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.512 -1.222 . . . . 10.0 111.142 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -87.4 0.45 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.803 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -89.87 122.4 67.96 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-O 120.658 0.266 . . . . 10.0 111.64 -178.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 59.5 Cg_endo -79.47 125.24 6.18 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.86 2.374 . . . . 10.0 111.954 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.427 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 20.1 ttmm -144.12 169.88 17.01 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . 0.427 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 3.2 m-85 -97.24 125.45 41.81 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.436 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.77 129.32 24.33 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 10.4 tt -105.12 124.08 59.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.249 0.547 . . . . 10.0 110.044 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.436 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.7 mtt85 -144.29 175.62 9.95 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.346 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -122.21 142.0 50.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.048 179.698 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -117.73 169.75 9.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.452 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 158.83 73.67 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -56.08 -34.55 93.02 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.153 1.902 . . . . 10.0 111.602 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -88.38 -4.19 58.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.555 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.72 34.93 19.81 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.349 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.68 -34.82 21.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.723 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -134.04 174.34 10.59 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.268 0.556 . . . . 10.0 111.568 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.89 167.79 21.02 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.607 -1.179 . . . . 10.0 110.4 -178.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.0 -161.46 9.42 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.955 -0.64 . . . . 10.0 112.387 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -96.75 148.28 23.05 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.432 -0.452 . . . . 10.0 111.57 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.86 -124.5 1.81 Allowed Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 111.323 -0.711 . . . . 10.0 111.323 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -148.21 142.23 19.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 117.499 0.65 . . . . 10.0 111.129 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.88 139.01 39.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.918 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 133.16 56.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.477 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.7 m -78.26 170.6 16.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.25 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.32 -52.58 64.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.294 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.561 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.9 pt-20 -58.97 -42.36 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.098 0.475 . . . . 10.0 110.641 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -62.4 -50.19 72.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.667 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.533 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.2 t80 -57.65 -43.19 84.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.586 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.69 -51.77 56.58 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.36 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 60' ' ' GLU . 35.5 t -62.57 -45.84 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 10.0 110.422 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.6 tp -56.43 -53.29 59.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.373 -0.83 . . . . 10.0 110.721 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 32.4 mt -59.9 -48.8 80.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.249 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -52.2 -53.65 40.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.757 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 8.9 mm-40 -69.92 -48.53 58.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.973 -178.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.467 ' HB3' HD23 ' A' ' 66' ' ' LEU . 47.6 mt -59.12 -42.95 91.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.551 0.215 . . . . 10.0 111.418 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.12 -38.97 97.01 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.599 -0.81 . . . . 10.0 111.294 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . 0.442 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.9 t-20 -71.05 -27.46 63.66 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 10.0 110.915 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.0 mmtt -66.99 -26.03 66.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.367 -0.379 . . . . 10.0 111.553 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 23.1 mt -89.62 -13.6 36.75 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.546 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . 0.442 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 42.9 mt-10 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.632 -0.699 . . . . 10.0 110.3 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.7 mmm . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 120.916 0.389 . . . . 10.0 110.304 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.47 179.91 4.13 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.061 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -82.8 -60.73 2.08 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -131.13 94.64 3.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.068 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.16 139.46 50.22 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.801 0.334 . . . . 10.0 110.272 179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -71.75 137.46 47.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.957 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.6 p90 -161.44 172.15 16.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.934 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -155.44 138.13 15.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.8 mt -85.47 113.64 24.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.923 0.392 . . . . 10.0 110.335 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.07 -44.05 17.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.964 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -167.78 128.59 1.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.331 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -79.62 136.5 36.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.498 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 58.3 mt -106.99 -75.08 0.64 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.386 0.514 . . . . 10.0 112.386 -178.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.421 HD11 ' HB3' ' B' ' 68' ' ' GLU . 31.8 mm -127.07 140.93 47.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 112.596 0.591 . . . . 10.0 112.596 -177.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.1 p -121.2 123.22 69.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 177.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 31.1 mt -92.25 -81.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.542 -0.463 . . . . 10.0 111.572 -178.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -179.98 -174.8 0.28 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 122.748 0.419 . . . . 10.0 110.006 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.58 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 26.5 mp0 -111.12 156.81 20.81 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -102.99 -169.94 1.72 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.003 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.9 -23.43 67.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.391 0.615 . . . . 10.0 110.515 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -87.82 -4.66 58.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.511 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.03 3.56 87.61 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.759 -0.655 . . . . 10.0 112.063 -178.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.58 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 42.0 m0 -55.24 102.54 0.07 Allowed 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.373 0.269 . . . . 10.0 111.649 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.548 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.4 tpp85 -80.22 100.3 8.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.405 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 81.0 mttt -82.35 113.2 19.97 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.89 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -139.26 153.9 47.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.35 0.595 . . . . 10.0 111.743 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.53 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 38.5 tp -123.07 107.67 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.933 -1.03 . . . . 10.0 108.26 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -133.94 166.11 23.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.927 0.394 . . . . 10.0 110.88 -177.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.4 ttp180 -105.58 114.9 29.35 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.184 -0.673 . . . . 10.0 109.184 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 m -126.15 162.12 30.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.498 -179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 36' ' ' GLU . 1.0 OUTLIER -99.29 123.12 43.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.948 0.404 . . . . 10.0 110.515 179.136 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 14.7 m0 -64.73 112.86 3.42 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.837 -0.619 . . . . 10.0 109.619 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 59.7 26.1 15.16 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.806 0.692 . . . . 10.0 110.207 -178.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t0 63.52 28.48 15.29 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.614 -1.176 . . . . 10.0 110.96 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.69 -74.66 0.61 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.068 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 31' ' ' SER . 45.7 tt0 -91.01 118.09 68.34 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.526 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 70.0 Cg_endo -82.58 120.79 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.601 2.201 . . . . 10.0 110.667 177.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -150.06 163.07 39.11 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.796 -0.362 . . . . 10.0 110.771 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -83.47 139.48 32.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.538 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -151.05 130.61 13.01 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.411 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -108.83 123.7 64.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.238 0.542 . . . . 10.0 110.111 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -149.1 174.4 12.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.222 -178.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.548 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 2.9 p -123.25 135.52 54.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 49.1 m0 -116.8 176.62 5.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.592 0.234 . . . . 10.0 110.693 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -66.86 153.64 93.71 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.406 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.41 -37.97 77.68 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.387 2.058 . . . . 10.0 111.561 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -83.76 -4.08 58.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.221 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 62.35 24.93 14.87 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.468 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -76.52 -31.73 57.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.973 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -140.07 174.13 10.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.33 0.586 . . . . 10.0 111.475 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.31 171.22 14.75 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.432 -178.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.15 -170.0 11.75 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.497 -0.859 . . . . 10.0 112.285 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -98.38 145.38 26.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.461 -0.435 . . . . 10.0 111.894 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.83 -111.87 0.85 Allowed Glycine 0 N--CA 1.453 -0.2 0 N-CA-C 110.952 -0.859 . . . . 10.0 110.952 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 tt -155.93 141.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 117.306 0.553 . . . . 10.0 110.803 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.2 m -98.44 141.67 31.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.139 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.3 mt -119.62 122.47 41.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.098 0.475 . . . . 10.0 110.543 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -80.93 168.34 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.578 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.13 -38.37 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.577 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.455 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -59.41 -47.84 83.92 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.388 178.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.455 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 29.5 mt-10 -66.96 -56.7 9.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.975 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.68 ' CE2' HD11 ' A' ' 66' ' ' LEU . 9.5 t80 -50.35 -45.84 55.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.437 -0.801 . . . . 10.0 111.956 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.1 -56.48 25.02 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.195 -0.526 . . . . 10.0 113.126 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.17 -43.53 91.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 10.0 111.14 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.438 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.0 tp -55.58 -51.61 66.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.973 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.68 HD11 ' CE2' ' A' ' 62' ' ' PHE . 20.5 mt -62.83 -45.47 92.45 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 121.002 -0.279 . . . . 10.0 111.121 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 ttpp -53.82 -52.63 59.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.89 -0.595 . . . . 10.0 111.005 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.562 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 15.8 mm-40 -69.69 -49.11 56.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.905 -178.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.9 mt -58.32 -44.78 88.81 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.624 0.25 . . . . 10.0 111.404 -179.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.24 -35.66 92.25 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.405 -0.902 . . . . 10.0 111.348 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -74.57 -18.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.867 0.365 . . . . 10.0 110.81 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.562 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 66.2 mmtt -75.19 -26.2 58.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.057 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 28.1 mt -90.1 -3.31 57.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.938 0.399 . . . . 10.0 110.565 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 118.481 -0.771 . . . . 10.0 110.336 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 90.3 mmm . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 120.878 0.37 . . . . 10.0 110.424 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.54 178.43 4.56 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.451 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -82.06 -58.25 3.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -131.79 94.04 3.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.226 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 27.4 tp -70.63 139.08 51.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.253 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -73.02 134.96 44.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 10.0 110.893 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -158.78 170.52 21.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.882 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.484 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.5 tp10 -153.08 134.35 14.22 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 52.2 mt -82.73 110.48 17.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.966 0.412 . . . . 10.0 110.413 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.4 mm -79.8 -48.61 20.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.635 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -164.96 129.46 2.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.229 -179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.93 144.51 36.78 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 57.8 mt -115.08 -70.75 0.78 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.231 -0.588 . . . . 10.0 112.433 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.429 HD12 ' HB3' ' A' ' 68' ' ' GLU . 15.3 mm -128.45 142.54 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.926 0.393 . . . . 10.0 111.847 -176.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.51 118.54 52.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.6 mt -88.23 -80.94 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -177.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 178.46 -172.24 0.13 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.591 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 24.0 mp0 -115.15 151.78 33.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.312 -0.403 . . . . 10.0 109.999 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -96.82 -167.88 1.62 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -15.17 63.44 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.345 0.593 . . . . 10.0 110.601 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -94.41 -2.01 52.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.957 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.31 4.31 90.23 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.275 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.591 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.6 m0 -56.94 102.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.5 tpp85 -80.15 100.6 8.33 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -82.25 113.76 20.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.898 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -139.83 155.1 47.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.438 0.637 . . . . 10.0 111.747 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.514 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 37.3 tp -124.24 107.91 11.7 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.191 -1.04 . . . . 10.0 108.191 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -133.9 164.42 27.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.918 0.39 . . . . 10.0 110.927 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.1 ttp180 -104.13 114.3 28.44 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.4 m -125.25 162.1 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.748 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.484 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -99.79 121.81 41.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.505 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 17.1 m0 -64.2 112.88 3.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.763 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 59.75 26.18 15.28 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.014 -178.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.0 t0 61.3 33.4 19.0 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 114.517 -1.22 . . . . 10.0 110.491 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.92 -70.05 0.81 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.064 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' B' ' 31' ' ' SER . 44.2 tt0 -94.92 117.58 66.83 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.601 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -81.64 120.16 3.47 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.372 2.048 . . . . 10.0 110.708 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 11.0 ttpt -150.24 163.23 38.81 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.804 -0.358 . . . . 10.0 110.708 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.88 138.51 32.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.347 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -150.04 130.5 13.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 9.2 tt -108.53 123.13 64.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.388 0.613 . . . . 10.0 110.14 -179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -149.03 175.47 11.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.574 -178.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.546 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 4.5 p -124.31 135.4 53.33 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -117.02 175.1 5.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.424 -0.213 . . . . 10.0 110.424 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.7 m -65.49 153.85 89.32 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.452 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.08 -34.97 89.07 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.424 2.083 . . . . 10.0 111.319 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.57 -4.75 59.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.049 -0.978 . . . . 10.0 110.23 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 61.98 23.81 14.08 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.783 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -76.7 -29.7 56.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -141.48 174.53 10.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.557 0.694 . . . . 10.0 111.953 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.15 171.8 13.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.32 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.72 -170.64 12.01 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.238 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.9 mttp -97.57 141.61 30.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.256 0.55 . . . . 10.0 112.426 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -138.57 -119.32 1.72 Allowed Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.386 -1.086 . . . . 10.0 110.386 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -149.43 143.14 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 117.27 0.535 . . . . 10.0 110.674 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 4.0 m -97.81 139.57 33.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.524 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -117.75 119.29 34.46 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.967 0.413 . . . . 10.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.7 166.93 21.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.314 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.0 -35.17 74.46 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.874 0.368 . . . . 10.0 110.922 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.422 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.9 pt-20 -61.75 -46.07 91.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.062 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.422 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 31.3 mt-10 -68.34 -57.21 6.27 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.863 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.493 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.5 t80 -52.15 -42.28 63.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.463 -0.789 . . . . 10.0 111.478 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.99 -55.52 30.43 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.875 -0.678 . . . . 10.0 112.954 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 19.1 t -68.66 -42.36 83.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.937 0.399 . . . . 10.0 110.865 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.0 tp -56.59 -50.93 70.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.021 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 60.1 mt -60.62 -50.69 72.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.726 0.298 . . . . 10.0 110.606 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 24.8 tttm -50.84 -53.04 35.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.8 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.543 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 30.6 mm-40 -69.4 -52.45 26.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.282 -178.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.488 ' HB3' HD23 ' A' ' 66' ' ' LEU . 62.4 mt -58.87 -43.13 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.91 -38.23 96.22 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.47 -0.872 . . . . 10.0 111.142 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . 0.404 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.4 t-20 -73.51 -20.06 60.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.504 -0.348 . . . . 10.0 111.359 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.8 mmtt -72.64 -27.51 62.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.658 0.266 . . . . 10.0 110.95 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.88 0.46 57.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.984 0.421 . . . . 10.0 111.019 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . 0.404 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.9 mt-10 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.789 -0.624 . . . . 10.0 109.892 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.756 0.312 . . . . 10.0 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.46 160.23 17.98 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -66.96 -53.4 32.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.236 -0.653 . . . . 10.0 109.236 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -139.98 95.23 2.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.195 -0.911 . . . . 10.0 109.697 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.5 tp -64.22 145.77 55.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.852 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.455 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.1 tppt? -79.25 136.48 37.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.47 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -164.32 163.53 22.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.189 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.446 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.8 tp10 -145.4 126.09 14.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.438 ' HA ' HG12 ' A' ' 30' ' ' VAL . 84.6 mt -73.83 110.77 8.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.002 0.429 . . . . 10.0 110.147 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mm -80.68 -48.89 19.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -162.96 126.65 2.88 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.042 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -78.39 144.31 36.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 68.7 mt -112.44 -75.46 0.61 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.565 -0.454 . . . . 10.0 111.625 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.0 mm -128.87 140.35 49.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.304 0.573 . . . . 10.0 112.49 -177.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.59 120.45 60.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 107.85 -1.167 . . . . 10.0 107.85 177.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.446 HD22 ' HB ' ' B' ' 64' ' ' VAL . 32.5 mt -89.72 -81.68 0.28 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.567 -0.453 . . . . 10.0 112.124 -177.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.2 m -174.51 -168.39 0.37 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -107.44 136.57 47.01 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.827 -0.435 . . . . 10.0 109.827 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -74.43 -173.83 1.85 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.793 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.06 68.45 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.614 0.721 . . . . 10.0 110.574 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -88.66 -1.07 57.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.811 -1.086 . . . . 10.0 110.91 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.36 1.62 81.01 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.125 -0.79 . . . . 10.0 111.125 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -59.06 106.05 0.38 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.838 0.351 . . . . 10.0 111.318 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.4 tpp85 -84.53 99.74 10.93 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.504 178.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.413 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 93.3 mttt -82.91 118.29 23.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.425 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -133.56 149.79 51.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.986 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 40.3 tp -117.76 108.11 14.97 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.612 -0.884 . . . . 10.0 108.612 178.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -135.63 160.97 36.85 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.791 0.329 . . . . 10.0 110.451 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 ttp180 -102.19 115.0 29.63 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.438 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.2 m -125.26 161.85 28.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.691 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.446 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.4 p -93.39 124.52 37.44 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -63.66 108.28 1.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 61.8 m-80 59.28 30.36 20.08 Favored 'General case' 0 CA--C 1.522 -0.108 0 O-C-N 123.869 0.73 . . . . 10.0 109.703 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 44.1 t0 62.91 26.69 15.67 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.365 -1.289 . . . . 10.0 111.09 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.26 -71.2 0.76 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.128 -0.357 . . . . 10.0 111.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -94.16 114.79 64.13 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.853 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 53.5 Cg_endo -78.27 119.9 4.74 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.164 1.909 . . . . 10.0 110.282 177.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -150.03 166.23 30.33 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.889 -0.324 . . . . 10.0 110.489 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -87.01 132.16 33.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 10.0 110.867 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.415 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -144.8 132.96 21.57 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.1 tt -109.88 121.83 63.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.356 0.598 . . . . 10.0 109.824 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.415 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.74 179.44 7.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.281 -177.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.52 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -128.05 146.01 50.81 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.197 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -117.23 178.16 4.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.938 -0.573 . . . . 10.0 109.783 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 p -80.36 161.41 64.97 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -57.63 -29.78 86.46 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.368 2.045 . . . . 10.0 112.612 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -100.5 0.16 39.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.135 0.493 . . . . 10.0 110.323 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 59.14 34.19 23.16 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.219 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.14 -37.22 22.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.102 0.477 . . . . 10.0 110.327 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -139.35 174.38 10.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.912 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.422 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -150.55 173.04 14.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.758 -177.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.42 -162.08 9.99 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.779 -0.724 . . . . 10.0 112.212 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -90.08 162.5 15.29 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.361 -0.493 . . . . 10.0 112.243 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -152.78 -121.63 0.89 Allowed Glycine 0 C--N 1.33 0.229 0 CA-C-N 115.248 -0.887 . . . . 10.0 111.277 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.2 tt -153.66 143.17 14.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 117.48 0.64 . . . . 10.0 110.969 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.01 145.73 30.03 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.955 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -125.94 132.11 52.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.007 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.417 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 1.4 m -75.36 161.61 29.12 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -57.12 -46.23 82.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.559 -179.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.49 -46.13 91.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.944 0.402 . . . . 10.0 110.585 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.417 ' CD ' ' HG ' ' A' ' 58' ' ' SER . 84.4 mt-10 -59.52 -49.59 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.355 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.566 ' CE2' HD12 ' A' ' 66' ' ' LEU . 15.6 t80 -57.07 -43.84 82.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.22 -0.9 . . . . 10.0 111.356 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.43 -56.3 25.99 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.717 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.87 -41.28 88.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.912 0.387 . . . . 10.0 110.373 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 17.4 tp -58.2 -54.6 45.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.872 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.566 HD12 ' CE2' ' A' ' 62' ' ' PHE . 22.2 mt -62.44 -46.29 89.19 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.757 -0.201 . . . . 10.0 111.465 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 tttm -50.4 -49.98 53.03 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.603 0.564 . . . . 10.0 111.459 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.593 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 13.3 mm-40 -72.35 -48.67 40.11 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.414 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 84.1 mt -57.41 -44.98 85.04 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.05 98.75 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.686 -0.769 . . . . 10.0 111.372 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.466 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 13.1 t-20 -68.06 -28.31 67.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.955 0.407 . . . . 10.0 111.057 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.593 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.6 mmtt -67.41 -28.9 68.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.087 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.5 mt -89.68 -4.86 57.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.682 -0.236 . . . . 10.0 111.126 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.466 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 41.1 mt-10 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.42 -0.8 . . . . 10.0 110.722 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.865 0.364 . . . . 10.0 110.406 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.4 161.78 13.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.2 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.01 -51.81 29.3 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -139.98 94.51 2.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.212 -0.904 . . . . 10.0 109.313 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.3 tp -62.35 145.12 54.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.121 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -79.43 134.08 36.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.658 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -163.44 161.71 24.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.449 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -142.38 130.22 21.7 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 65.5 mt -78.26 105.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.939 0.4 . . . . 10.0 110.802 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 40.8 mm -75.99 -47.42 32.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.619 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -164.04 127.33 2.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.08 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -79.67 141.72 36.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.5 mt -112.09 -72.98 0.69 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.381 -0.528 . . . . 10.0 112.354 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.438 HD12 HG23 ' B' ' 14' ' ' ILE . 18.6 mm -127.81 140.39 49.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.107 0.48 . . . . 10.0 112.074 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -125.26 115.47 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -84.94 -82.19 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.207 0.447 . . . . 10.0 112.207 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.0 m -177.42 -167.9 0.17 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -107.03 138.25 43.55 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -76.93 -172.67 2.4 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.868 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.87 -13.92 62.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.41 0.624 . . . . 10.0 111.417 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -101.14 2.27 40.02 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.885 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 2.22 85.2 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.269 -178.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 41.1 m0 -59.93 106.06 0.46 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.975 0.417 . . . . 10.0 111.484 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.1 tpp85 -84.57 100.03 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.646 178.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -82.53 118.73 23.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.908 0.385 . . . . 10.0 110.486 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -133.54 148.32 51.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.93 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.498 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 41.4 tp -118.03 107.74 14.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.412 -0.959 . . . . 10.0 108.412 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -135.99 162.5 32.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.893 0.377 . . . . 10.0 110.743 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -103.2 114.83 29.44 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.4 m -123.85 162.2 25.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.46 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.408 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.1 p -93.91 123.41 37.25 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.865 -0.421 . . . . 10.0 109.865 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.21 108.01 1.18 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.476 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.7 m-80 60.05 29.26 18.84 Favored 'General case' 0 CA--C 1.523 -0.082 0 O-C-N 123.707 0.629 . . . . 10.0 109.773 -177.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t0 61.27 34.57 18.56 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.7 -1.136 . . . . 10.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.09 -71.61 0.72 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.083 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.461 ' CD ' ' HZ3' ' B' ' 38' ' ' LYS . 46.4 tt0 -91.77 114.58 62.41 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.385 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.408 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 39.3 Cg_endo -80.64 118.7 3.54 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.773 1.649 . . . . 10.0 109.964 178.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.461 ' HZ3' ' CD ' ' B' ' 36' ' ' GLU . 16.8 ttpt -148.23 166.62 27.39 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 110.217 -0.29 . . . . 10.0 110.217 -177.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -87.56 132.79 33.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.583 -0.281 . . . . 10.0 110.666 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.42 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -145.57 132.07 19.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.99 -0.744 . . . . 10.0 108.99 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 9.3 tt -108.94 121.65 62.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.442 0.639 . . . . 10.0 109.915 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.42 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.2 mtt85 -144.11 179.88 6.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.307 -178.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -128.86 146.3 50.97 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.402 -179.762 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -117.56 176.66 5.07 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.941 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -77.64 161.15 72.94 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.211 -0.662 . . . . 10.0 109.211 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.41 -30.25 87.31 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.268 1.979 . . . . 10.0 112.16 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -97.14 -4.98 38.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.74 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 64.01 29.83 14.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.558 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -82.35 -37.31 25.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.111 0.481 . . . . 10.0 110.293 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -137.54 171.77 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.984 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' MET . . . . . 0.405 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -148.82 173.13 13.6 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.577 -178.068 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.86 -158.45 8.84 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.849 -0.691 . . . . 10.0 112.271 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -92.64 160.63 14.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.16 0.505 . . . . 10.0 112.307 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -152.31 -127.95 1.33 Allowed Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.654 -0.979 . . . . 10.0 110.654 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.5 tt -147.98 143.32 19.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 117.511 0.656 . . . . 10.0 111.24 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -103.67 145.02 30.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.685 -0.688 . . . . 10.0 111.132 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 81.5 mt -125.8 131.63 52.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.266 -0.424 . . . . 10.0 109.99 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -75.29 161.33 29.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.17 -47.0 82.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.702 0.287 . . . . 10.0 111.657 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.452 ' O ' HG21 ' B' ' 64' ' ' VAL . 12.1 pt-20 -62.17 -42.16 99.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.987 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -63.12 -48.72 77.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.868 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.516 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -59.29 -40.19 85.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.756 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.28 -56.06 27.3 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.176 -0.535 . . . . 10.0 112.625 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.452 HG21 ' O ' ' B' ' 60' ' ' GLU . 8.1 t -62.16 -41.69 92.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.001 0.429 . . . . 10.0 110.486 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.3 tp -58.03 -54.48 46.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.048 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 51.1 mt -61.31 -48.45 81.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.577 -0.283 . . . . 10.0 111.219 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -49.57 -52.71 28.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.844 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.642 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 8.0 mm-40 -71.31 -48.22 51.9 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.958 -178.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.42 ' HB3' HD23 ' A' ' 66' ' ' LEU . 60.5 mt -58.57 -45.24 89.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.71 -0.223 . . . . 10.0 111.56 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.64 96.24 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.685 -0.769 . . . . 10.0 111.358 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . 0.549 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.6 t-20 -70.9 -26.61 63.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.931 0.396 . . . . 10.0 111.149 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.3 mmtt -68.28 -27.21 66.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.272 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 22.5 mt -90.9 -2.35 57.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.974 -0.29 . . . . 10.0 111.446 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . 0.549 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.4 mt-10 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.606 -0.711 . . . . 10.0 110.038 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.894 0.378 . . . . 10.0 110.572 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.78 161.83 16.47 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.85 -58.74 5.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.986 0.422 . . . . 10.0 110.291 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.12 93.48 3.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.004 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.78 141.16 58.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -74.25 132.39 42.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -156.77 166.19 34.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.958 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.425 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.7 tp10 -154.56 129.39 9.39 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -78.11 114.68 19.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.106 0.479 . . . . 10.0 110.147 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.7 mm -85.28 -41.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.171 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -169.42 127.73 0.97 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.685 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -75.28 143.94 42.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 85.2 mt -114.78 -73.7 0.64 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.349 -0.541 . . . . 10.0 111.626 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.404 HD11 ' O ' ' A' ' 13' ' ' LEU . 28.7 mm -129.19 143.85 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 10.0 112.315 -177.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.7 p -128.24 123.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 108.205 -1.035 . . . . 10.0 108.205 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.4 mt -91.49 -81.37 0.33 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.263 -0.575 . . . . 10.0 111.5 -178.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -177.27 -171.87 0.36 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -104.1 133.46 49.01 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -73.5 -173.72 1.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.684 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.86 -30.63 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.72 0.771 . . . . 10.0 110.31 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -83.64 -2.14 55.48 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.544 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.02 2.28 81.08 Favored Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.406 -0.902 . . . . 10.0 110.947 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 40.9 m0 -60.03 105.57 0.41 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.981 0.42 . . . . 10.0 111.191 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.488 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.3 tpp85 -82.77 100.11 10.08 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.492 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.452 ' HZ1' ' CD ' ' B' ' 61' ' ' GLU . 86.9 mttt -80.92 115.09 20.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.435 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -133.09 154.25 50.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.998 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 36.1 tp -125.42 107.96 11.18 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -134.9 156.72 48.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.804 0.335 . . . . 10.0 110.899 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -90.76 114.72 27.16 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.03 -0.73 . . . . 10.0 109.03 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.7 m -126.03 156.54 36.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.805 0.336 . . . . 10.0 110.763 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.48 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.8 p -94.45 122.94 37.54 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.933 0.397 . . . . 10.0 110.565 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -64.42 109.47 1.95 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.049 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.0 m-80 60.33 31.04 20.29 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.67 -0.696 . . . . 10.0 110.151 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.19 17.05 10.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.548 -1.205 . . . . 10.0 111.222 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.07 -97.79 0.28 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.446 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.78 124.48 85.04 Favored Pre-proline 0 C--O 1.234 0.247 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.48 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.9 Cg_endo -80.09 123.78 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.832 2.355 . . . . 10.0 111.456 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -142.27 167.23 22.59 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.738 -0.385 . . . . 10.0 110.169 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -92.36 128.74 38.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.127 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.439 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.7 t70 -141.69 130.45 22.89 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.422 ' HB ' HD12 ' A' ' 27' ' ' LEU . 10.4 tt -106.45 122.33 60.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 110.03 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.439 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.7 mtt85 -144.87 -178.35 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.105 -177.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -127.68 142.4 51.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.817 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -117.47 175.06 5.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 10.0 109.783 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.53 159.67 71.53 Favored Pre-proline 0 C--N 1.32 -0.703 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -59.58 -28.38 87.28 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.347 2.032 . . . . 10.0 111.981 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -93.43 -5.51 49.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.126 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.12 31.61 21.43 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.563 -179.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 50' ' ' LYS . 13.5 pt-20 -81.74 -40.0 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.531 -0.759 . . . . 10.0 110.927 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.409 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 44.8 mmtm -140.24 173.64 11.31 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.82 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.421 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -148.38 172.23 14.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.708 -177.755 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -130.51 -154.65 8.05 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.708 -0.758 . . . . 10.0 112.232 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -100.46 155.23 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.253 -0.557 . . . . 10.0 112.221 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.6 -120.27 1.23 Allowed Glycine 0 CA--C 1.518 0.246 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.921 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -150.52 142.66 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 117.564 0.682 . . . . 10.0 111.275 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.28 146.01 29.41 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.771 -0.65 . . . . 10.0 111.011 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.7 mt -131.55 127.18 36.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 m -80.26 171.61 14.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.699 0.285 . . . . 10.0 111.194 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -52.16 -59.43 4.38 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -59.52 -45.58 91.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.622 0.249 . . . . 10.0 111.641 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -59.86 -50.18 74.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 10.0 110.7 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.56 ' CE2' HD13 ' A' ' 66' ' ' LEU . 39.9 t80 -62.18 -41.68 98.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.397 -0.819 . . . . 10.0 111.215 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.77 57.22 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 116.069 -0.514 . . . . 10.0 112.913 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.43 -41.68 93.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.903 0.383 . . . . 10.0 110.226 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -57.31 -52.27 66.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.45 179.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.56 HD13 ' CE2' ' A' ' 62' ' ' PHE . 18.1 mt -62.38 -45.21 94.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.733 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -51.99 -50.13 61.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.172 -179.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.572 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 5.5 mm-40 -72.71 -46.31 54.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.664 -179.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 60.9 mt -58.34 -45.34 88.3 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.8 0.333 . . . . 10.0 111.575 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.38 -39.86 98.24 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 111.166 -0.774 . . . . 10.0 111.166 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.45 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 18.0 t-20 -67.22 -29.82 69.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.994 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.4 mmtt -68.12 -27.3 66.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.735 0.302 . . . . 10.0 110.731 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 25.5 mt -89.47 -8.45 52.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.039 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.45 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 33.4 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.62 -0.705 . . . . 10.0 110.029 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 CA-C-O 120.918 0.389 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.49 165.17 11.33 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.757 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -69.06 -58.95 3.41 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -133.42 94.71 3.36 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 28.7 tp -65.93 140.94 58.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.25 179.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 14.9 tppt? -75.28 131.14 40.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.398 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -154.5 168.47 26.61 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.266 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.464 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.6 tp10 -155.86 128.2 7.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.8 mt -78.13 110.83 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.492 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 25.7 mm -80.92 -42.46 20.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.479 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -169.34 126.85 0.94 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.434 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -74.84 144.41 43.46 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 68.0 mt -115.8 -72.85 0.67 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.447 -0.501 . . . . 10.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.403 HD11 ' CB ' ' A' ' 68' ' ' GLU . 22.4 mm -127.86 142.93 42.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.281 0.562 . . . . 10.0 112.144 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.405 HG21 ' HG2' ' B' ' 26' ' ' GLU . 3.6 p -126.8 126.38 68.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 107.801 -1.185 . . . . 10.0 107.801 177.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 52.2 mt -93.91 -81.56 0.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.687 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.27 -172.31 0.3 Allowed 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.435 -0.579 . . . . 10.0 109.435 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -104.46 129.35 52.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -70.59 -174.92 0.95 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.998 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.83 -27.9 69.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.356 0.598 . . . . 10.0 110.841 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -88.42 0.7 55.95 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.78 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.36 2.04 83.2 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.117 -0.793 . . . . 10.0 111.117 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -60.0 105.51 0.4 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.001 0.429 . . . . 10.0 111.445 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.496 ' O ' ' HA ' ' B' ' 43' ' ' THR . 11.7 tpp85 -81.7 100.8 9.68 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.769 178.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -81.08 116.85 21.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.625 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . 0.405 ' HG2' HG21 ' B' ' 15' ' ' VAL . 62.9 mt-10 -135.31 152.87 51.9 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.978 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.454 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 38.4 tp -125.34 108.05 11.3 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -134.84 156.0 49.67 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.112 -177.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' B' ' 29' ' ' ARG . 39.5 ttm180 -89.59 114.57 26.18 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 m -125.78 156.41 35.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.775 0.321 . . . . 10.0 110.455 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.464 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.0 OUTLIER -94.09 124.28 38.01 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.362 179.184 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -65.16 109.66 2.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 10.0 109.934 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.402 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.1 m-80 60.93 30.98 19.95 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.151 -178.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 66.36 22.07 10.85 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.801 -1.09 . . . . 10.0 110.778 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.08 -96.86 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.419 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -78.66 122.85 85.35 Favored Pre-proline 0 C--O 1.234 0.24 0 CA-C-O 120.845 0.355 . . . . 10.0 111.854 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.7 Cg_endo -79.66 124.02 5.56 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.913 2.409 . . . . 10.0 111.255 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -143.45 169.03 18.45 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.02 -0.363 . . . . 10.0 110.02 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.29 128.97 41.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -141.69 129.33 21.53 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 8.6 tt -105.23 122.81 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 10.0 110.084 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.426 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -145.04 -178.6 6.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.239 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.496 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -128.09 142.67 51.14 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 109.942 179.561 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -117.6 174.15 6.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.837 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.83 159.55 76.11 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.95 -26.6 82.81 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.332 2.021 . . . . 10.0 111.954 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -95.12 -5.52 43.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.037 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.84 31.35 20.72 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.538 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' B' ' 50' ' ' LYS . 11.5 pt-20 -81.49 -39.76 24.28 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.893 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . 0.437 ' N ' ' HG3' ' B' ' 49' ' ' GLU . 39.1 mmtm -139.43 173.05 11.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.808 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' MET . . . . . 0.43 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -146.78 172.38 13.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.524 -177.975 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.17 -154.69 7.94 Favored Glycine 0 C--O 1.228 -0.278 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.34 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -101.08 150.49 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 122.298 -0.531 . . . . 10.0 112.264 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.51 -123.14 1.88 Allowed Glycine 0 C--N 1.332 0.311 0 N-CA-C 110.595 -1.002 . . . . 10.0 110.595 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -147.93 142.59 19.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 117.653 0.726 . . . . 10.0 111.065 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 140.76 37.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.338 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 52.4 mt -126.2 126.79 44.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.095 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m -78.68 173.86 12.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.831 0.348 . . . . 10.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -57.16 -56.73 18.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.105 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.556 ' O ' HG22 ' B' ' 64' ' ' VAL . 11.7 pt-20 -61.16 -44.17 97.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.651 0.262 . . . . 10.0 111.494 -179.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.452 ' CD ' ' HZ1' ' A' ' 25' ' ' LYS . 50.2 mt-10 -62.77 -48.05 80.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.015 0.436 . . . . 10.0 110.749 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -64.64 -38.58 91.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.436 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.84 -53.66 44.42 Favored Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.117 -0.492 . . . . 10.0 112.549 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.556 HG22 ' O ' ' B' ' 60' ' ' GLU . 20.5 t -61.42 -43.33 96.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 10.0 110.047 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.4 tp -57.26 -52.48 65.15 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.615 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 80.9 mt -59.32 -51.51 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.18 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.1 tttm -48.52 -52.09 24.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.873 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.6 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 14.5 mm-40 -71.15 -48.12 53.78 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.951 -178.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.441 ' HB3' HD22 ' A' ' 66' ' ' LEU . 55.9 mt -58.89 -44.55 91.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.98 -41.11 99.64 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.924 -0.87 . . . . 10.0 110.924 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . 0.456 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 12.0 t-20 -67.08 -30.0 69.92 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.909 0.385 . . . . 10.0 111.258 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.7 mmtt -65.13 -31.34 72.48 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.312 -0.242 . . . . 10.0 111.146 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 26.5 mt -90.12 -5.85 56.06 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.718 -0.393 . . . . 10.0 111.642 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . 0.456 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 28.1 mt-10 . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.622 -0.704 . . . . 10.0 110.47 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.941 0.4 . . . . 10.0 110.177 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.76 162.53 13.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.9 -53.0 14.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -133.93 94.8 3.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.006 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 21.9 tp -67.73 144.4 55.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.605 178.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -77.58 133.4 38.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.701 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -161.1 172.91 15.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.471 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.6 133.96 11.65 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.1 mt -83.8 107.9 15.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 120.985 0.421 . . . . 10.0 110.031 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.2 mm -76.0 -45.85 35.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -165.23 131.18 2.7 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.632 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.21 144.63 34.22 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 83.1 mt -113.7 -74.63 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.279 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.43 HD11 ' HB3' ' B' ' 68' ' ' GLU . 26.0 mm -132.1 139.15 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.246 0.546 . . . . 10.0 112.171 -177.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -120.17 122.21 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.851 -1.166 . . . . 10.0 107.851 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.0 mt -89.03 -80.67 0.29 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.533 -0.467 . . . . 10.0 111.917 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 m 179.2 -169.41 0.1 Allowed 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.407 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 32.9 mp0 -106.45 146.27 30.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.263 179.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -87.86 -170.39 2.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.27 -24.56 67.7 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.532 0.682 . . . . 10.0 110.71 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -93.9 3.28 55.61 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.061 -0.972 . . . . 10.0 110.757 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.75 8.08 86.47 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.8 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.407 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -60.82 103.97 0.31 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.755 0.312 . . . . 10.0 111.5 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.1 tpp85 -81.58 99.26 8.74 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -85.37 117.82 24.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.918 0.39 . . . . 10.0 110.612 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -135.12 153.71 51.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.529 -0.759 . . . . 10.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.516 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 34.9 tp -123.16 107.23 11.5 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -135.79 154.96 51.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.315 -178.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 29' ' ' ARG . 8.1 ttp180 -91.24 115.05 27.71 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 178.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.5 m -123.85 160.43 27.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.696 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.471 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -97.29 122.83 40.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.349 179.059 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.5 m0 -63.64 110.97 2.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.898 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 58.36 30.29 19.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.41 0.624 . . . . 10.0 110.18 -178.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.9 t70 62.53 29.64 17.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.802 -1.09 . . . . 10.0 111.028 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.7 -74.98 0.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 O-C-N 122.103 -0.373 . . . . 10.0 111.49 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.51 112.69 50.04 Favored Pre-proline 0 C--N 1.328 -0.357 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.8 Cg_endo -80.45 120.18 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.392 2.061 . . . . 10.0 110.714 178.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttpt -152.35 172.22 16.8 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.843 -0.343 . . . . 10.0 110.482 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -91.06 134.94 34.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.675 0.274 . . . . 10.0 111.262 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -146.88 130.45 16.85 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.466 ' HB ' HD12 ' A' ' 27' ' ' LEU . 11.6 tt -107.14 123.45 62.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.283 0.563 . . . . 10.0 110.194 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -146.32 179.28 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.34 -177.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -126.82 145.11 50.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.147 179.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -117.4 173.5 6.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.457 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -76.69 156.57 82.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.17 -33.08 95.24 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.396 2.064 . . . . 10.0 112.943 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -97.27 2.85 51.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.811 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 56.99 41.68 27.31 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.266 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.78 -37.21 14.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.622 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -142.21 174.36 10.68 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.019 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.68 172.43 13.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.458 -0.792 . . . . 10.0 111.234 -177.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -134.74 -165.89 10.98 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 121.182 -0.533 . . . . 10.0 111.917 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.6 mttp -94.53 156.16 16.58 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.024 -0.692 . . . . 10.0 111.988 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -150.67 -130.76 1.76 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.017 -0.833 . . . . 10.0 111.017 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 tt -144.23 143.72 23.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 117.723 0.761 . . . . 10.0 111.44 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.73 144.2 31.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.966 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -125.01 131.53 53.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.379 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.492 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 1.0 OUTLIER -78.94 162.92 25.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.553 179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.9 -51.7 66.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -178.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.06 -44.68 97.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.777 0.323 . . . . 10.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.492 ' CD ' ' HG ' ' A' ' 58' ' ' SER . 79.8 mt-10 -62.19 -45.72 92.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.448 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.514 ' CE2' HD13 ' A' ' 66' ' ' LEU . 29.2 t80 -61.39 -42.61 99.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.019 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.48 -53.76 43.46 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.394 -0.432 . . . . 10.0 112.457 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.5 t -59.97 -41.63 86.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.986 0.422 . . . . 10.0 110.262 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.1 tp -59.97 -53.98 51.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.713 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.514 HD13 ' CE2' ' A' ' 62' ' ' PHE . 17.3 mt -60.89 -46.88 88.88 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.637 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.6 tttm -49.93 -55.28 15.06 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.735 0.647 . . . . 10.0 111.43 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 26.2 mm-40 -68.9 -45.45 70.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.736 -0.666 . . . . 10.0 111.788 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 67.4 mt -59.17 -45.41 91.08 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.898 0.38 . . . . 10.0 111.434 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.78 -36.74 93.77 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.932 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.405 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 6.8 t-20 -74.37 -28.48 61.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.807 0.337 . . . . 10.0 110.919 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.6 mmtt -66.86 -28.43 68.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.898 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.4 mt -85.4 -2.38 58.04 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.773 0.286 . . . . 10.0 111.773 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.405 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 46.9 mt-10 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.507 -0.759 . . . . 10.0 110.831 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 120.881 0.372 . . . . 10.0 110.116 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.28 163.17 13.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -75.54 -47.91 24.77 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -136.9 94.0 2.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.832 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.9 tp -67.64 143.05 56.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.592 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.523 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.7 tppt? -78.16 131.7 37.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.649 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -159.49 174.43 14.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.843 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -156.56 133.19 10.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -83.59 104.17 11.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.16 0.505 . . . . 10.0 110.582 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.5 mm -71.8 -50.29 39.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.504 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -159.99 128.19 4.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.232 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -75.54 145.46 41.25 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.534 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 93.6 mt -116.61 -70.94 0.76 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.248 -0.581 . . . . 10.0 111.892 -179.369 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.421 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.2 mm -133.46 140.4 46.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.09 0.472 . . . . 10.0 111.654 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.88 119.82 57.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 107.589 -1.263 . . . . 10.0 107.589 177.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.5 mt -86.51 -81.42 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.453 -0.499 . . . . 10.0 111.971 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.54 -168.5 0.15 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.457 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 30.1 mp0 -108.97 142.06 40.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 178.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -82.57 -169.72 2.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.908 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.84 65.75 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.326 0.584 . . . . 10.0 111.012 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 24.8 mttt -94.35 4.24 54.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.088 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.85 5.86 88.97 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.752 -0.737 . . . . 10.0 111.823 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.457 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -59.36 106.1 0.41 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.726 0.298 . . . . 10.0 111.452 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -83.58 99.76 10.38 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.4 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 92.5 mttt -84.95 117.71 24.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 110.818 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -134.76 154.05 51.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.949 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.534 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 46.7 tp -123.96 107.41 11.31 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 178.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -135.52 152.54 51.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.175 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -88.83 114.47 25.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.3 m -123.07 161.63 24.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.661 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 0.3 OUTLIER -97.51 123.94 41.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.89 0.376 . . . . 10.0 110.246 179.093 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -64.07 109.4 1.81 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.839 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.523 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.7 m-80 59.46 30.23 19.88 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.109 -178.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.6 t70 63.53 29.55 15.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.994 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -122.58 -71.76 0.71 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.491 -0.322 . . . . 10.0 111.786 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.45 ' CD ' ' HZ3' ' B' ' 38' ' ' LYS . 47.5 tt0 -89.18 112.58 52.0 Favored Pre-proline 0 C--N 1.329 -0.316 0 N-CA-C 111.887 0.328 . . . . 10.0 111.887 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 56.3 Cg_endo -79.8 119.65 4.07 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.017 1.811 . . . . 10.0 110.562 178.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.45 ' HZ3' ' CD ' ' B' ' 36' ' ' GLU . 15.9 ttpt -151.42 173.5 14.48 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.719 -0.392 . . . . 10.0 110.171 -178.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -93.28 135.52 34.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.57 0.224 . . . . 10.0 111.159 -179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -147.44 129.81 15.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . 0.404 ' HB ' HD11 ' B' ' 27' ' ' LEU . 11.8 tt -105.7 123.29 60.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.247 0.546 . . . . 10.0 110.115 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.5 mtt85 -146.11 178.75 7.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.418 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.491 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -126.16 145.15 50.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.984 179.957 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -117.76 174.13 6.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.186 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 156.26 82.38 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 178.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.77 -36.42 98.55 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.433 2.088 . . . . 10.0 112.662 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.34 1.81 56.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.028 0.442 . . . . 10.0 110.697 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.59 44.99 20.03 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.11 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -93.5 -37.55 11.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.622 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -140.25 173.4 11.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.333 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.86 170.74 15.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.985 -1.007 . . . . 10.0 110.819 -178.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.54 -165.95 11.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.127 -0.559 . . . . 10.0 111.762 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.6 151.94 18.91 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.139 -0.624 . . . . 10.0 111.872 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.58 -133.13 2.43 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.176 -0.92 . . . . 10.0 110.83 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -142.22 145.36 23.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 117.498 0.649 . . . . 10.0 111.478 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -103.55 144.92 30.78 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.353 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.51 130.28 51.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.244 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' SER . . . . . 0.417 ' HG ' ' CD ' ' B' ' 61' ' ' GLU . 1.3 m -77.95 163.43 25.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -56.62 -52.73 63.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -58.98 -44.37 91.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 10.0 111.157 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.417 ' CD ' ' HG ' ' B' ' 58' ' ' SER . 66.6 mt-10 -63.95 -45.37 89.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.706 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.447 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.9 t80 -63.21 -39.69 95.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.328 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.87 -52.39 53.22 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.304 179.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 21.5 t -60.87 -43.97 96.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.088 0.471 . . . . 10.0 109.933 179.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.93 -55.53 33.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.917 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 52.5 mt -57.98 -50.74 72.34 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.354 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -49.38 -55.13 13.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.022 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.43 ' HB3' HD11 ' A' ' 14' ' ' ILE . 36.6 mm-40 -69.05 -45.85 69.33 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.88 -178.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.469 ' HB3' HD23 ' A' ' 66' ' ' LEU . 71.7 mt -60.88 -44.23 97.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.813 0.339 . . . . 10.0 111.648 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.32 -37.53 94.74 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.735 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . 0.477 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.3 t-20 -73.3 -31.47 64.05 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.843 0.354 . . . . 10.0 110.765 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.42 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.3 mmtt -64.09 -25.88 68.3 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.55 0.574 . . . . 10.0 112.55 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.405 ' CD1' ' HB3' ' A' ' 66' ' ' LEU . 26.0 mt -90.42 4.94 49.53 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.829 -0.348 . . . . 10.0 111.689 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . 0.477 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.7 mt-10 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.325 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 CA-C-O 120.845 0.355 . . . . 10.0 110.558 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.64 168.53 9.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.194 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -64.74 -58.35 6.49 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -136.75 110.69 8.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.066 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.0 tp -80.38 133.12 35.87 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.0 tppt? -67.65 133.79 49.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.829 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -158.1 168.03 28.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.42 . . . . 10.0 109.919 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.485 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 12.3 tp10 -149.19 125.54 10.86 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.886 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.4 mt -79.31 106.08 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.55 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.6 mm -72.06 -46.08 60.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.01 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.81 132.57 1.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.651 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -75.93 145.12 40.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.969 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 79.5 mt -112.65 -74.79 0.62 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.662 -0.415 . . . . 10.0 111.635 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.459 HD13 ' O ' ' A' ' 13' ' ' LEU . 30.6 mm -132.37 137.37 54.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.767 0.655 . . . . 10.0 112.767 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 p -118.85 125.36 74.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.1 mt -94.18 -81.32 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 10.0 112.073 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.0 m -172.88 -168.36 0.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.77 -0.456 . . . . 10.0 109.77 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 2.2 mp0 -112.37 135.06 53.52 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -73.27 -173.67 1.4 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.75 0.31 . . . . 10.0 110.728 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.82 -20.79 66.59 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.611 0.72 . . . . 10.0 109.896 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -91.1 -1.81 57.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.767 -1.106 . . . . 10.0 110.522 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 1.19 85.99 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.987 -0.845 . . . . 10.0 110.987 -178.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.514 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.2 m0 -60.27 108.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.82 0.343 . . . . 10.0 111.606 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.5 ' O ' ' HA ' ' A' ' 43' ' ' THR . 6.8 tpp85 -86.93 99.61 11.99 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.407 178.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.481 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 86.2 mttt -83.05 118.54 23.6 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.07 0.462 . . . . 10.0 110.587 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -133.52 145.17 49.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.853 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.55 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 40.7 tp -115.38 107.86 15.77 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -133.77 159.1 41.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.933 0.397 . . . . 10.0 110.958 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -94.08 114.09 26.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.1 m -127.31 158.77 38.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.896 0.379 . . . . 10.0 110.821 -179.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.485 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -98.41 125.53 43.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.958 0.409 . . . . 10.0 110.475 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -64.23 108.95 1.71 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.843 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 61.19 25.66 15.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.027 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.9 t70 66.89 21.81 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.794 -1.093 . . . . 10.0 110.437 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.12 -75.92 0.61 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.281 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -98.89 120.74 57.94 Favored Pre-proline 0 C--N 1.329 -0.292 0 N-CA-C 111.776 0.287 . . . . 10.0 111.776 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.3 Cg_endo -79.45 120.81 4.53 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.861 2.374 . . . . 10.0 111.477 178.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.9 ttmm -143.52 168.49 19.74 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -92.02 129.5 37.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.596 0.236 . . . . 10.0 110.694 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.447 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -141.83 132.46 25.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.8 tt -110.78 121.21 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.239 0.542 . . . . 10.0 110.048 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.447 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.8 mtt85 -143.23 -178.74 6.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.446 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -125.61 143.02 51.21 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.125 179.5 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -117.91 169.31 9.74 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.664 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.18 156.46 87.99 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.62 -27.81 84.04 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.267 1.978 . . . . 10.0 112.048 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -94.75 -0.86 53.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.817 -0.628 . . . . 10.0 110.417 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 58.71 31.37 21.09 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.718 -0.673 . . . . 10.0 111.004 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -82.08 -36.41 27.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.895 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -137.8 175.22 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.359 0.599 . . . . 10.0 111.332 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.1 172.21 13.33 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.86 -1.064 . . . . 10.0 110.558 -178.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.08 -164.9 10.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.971 -0.633 . . . . 10.0 112.157 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -96.31 151.74 19.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.937 -0.743 . . . . 10.0 112.073 -179.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.26 -126.98 1.53 Allowed Glycine 0 C--N 1.332 0.349 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.21 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 tt -142.98 145.06 23.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-N 117.599 0.7 . . . . 10.0 111.453 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -107.7 139.96 41.48 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.886 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 36.7 mt -124.19 132.31 53.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.889 0.376 . . . . 10.0 110.275 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 m -76.56 164.55 25.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.934 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -60.82 -44.04 97.43 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.701 0.259 . . . . 10.0 111.701 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -60.43 -47.29 86.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.197 0.522 . . . . 10.0 110.708 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HB3' HD13 ' B' ' 16' ' ' LEU . 38.6 mt-10 -64.03 -45.2 89.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.597 179.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.569 ' CE2' HD12 ' A' ' 66' ' ' LEU . 20.3 t80 -58.25 -44.45 88.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.329 -0.85 . . . . 10.0 111.005 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.54 -52.72 51.45 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.312 -0.47 . . . . 10.0 112.379 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.5 t -61.9 -42.85 96.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 120.969 0.414 . . . . 10.0 110.587 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.529 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.8 tp -57.42 -55.65 32.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.584 -0.735 . . . . 10.0 110.932 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.569 HD12 ' CE2' ' A' ' 62' ' ' PHE . 20.3 mt -63.25 -43.03 99.17 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.007 -0.277 . . . . 10.0 111.614 -179.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.3 ttpp -51.56 -51.54 54.52 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.424 0.453 . . . . 10.0 111.189 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 32.8 mm-40 -71.89 -44.18 64.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.394 -179.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 73.2 mt -58.8 -45.31 90.19 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.26 94.54 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.6 -0.809 . . . . 10.0 111.092 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.25 -29.69 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 10.0 110.591 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 34.3 mmtt -68.67 -25.25 64.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.22 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 37.4 mt -89.55 -0.79 57.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.666 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.138 -0.934 . . . . 10.0 111.019 -179.216 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.03 0.443 . . . . 10.0 110.553 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.98 164.78 11.69 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -62.57 -58.26 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.464 0.649 . . . . 10.0 109.449 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -134.15 112.92 11.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.056 -0.975 . . . . 10.0 109.36 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 32.2 tp -82.33 133.95 35.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.457 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.6 tppt? -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.948 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -155.48 163.84 39.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.254 -0.43 . . . . 10.0 109.842 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.478 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.5 tp10 -145.97 126.49 14.14 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.597 -0.52 . . . . 10.0 109.597 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 39.5 mt -79.6 108.78 13.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.453 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -74.86 -45.1 44.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.874 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -170.15 134.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.655 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -76.89 144.56 38.85 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.616 179.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 76.2 mt -113.76 -72.21 0.71 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.449 -0.5 . . . . 10.0 112.08 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.431 HD11 ' CB ' ' A' ' 68' ' ' GLU . 13.2 mm -131.52 139.15 51.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.038 0.447 . . . . 10.0 111.996 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 p -122.83 123.89 69.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.665 -1.235 . . . . 10.0 107.665 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 61' ' ' GLU . 41.4 mt -93.38 -82.06 0.35 Allowed 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.045 -0.662 . . . . 10.0 112.023 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.6 m -174.19 -167.9 0.36 Allowed 'General case' 0 C--O 1.236 0.388 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.516 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 2.0 mp0 -111.87 134.99 53.07 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 10.0 109.916 178.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -72.73 -175.87 1.82 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.51 66.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.518 0.675 . . . . 10.0 110.211 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -89.7 -3.49 58.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.265 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.94 3.37 79.95 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.234 -0.746 . . . . 10.0 111.234 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.516 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -61.59 108.58 1.0 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.686 0.279 . . . . 10.0 111.483 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.514 ' O ' ' HA ' ' B' ' 43' ' ' THR . 5.5 tpp85 -86.49 99.97 12.04 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.351 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.462 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 86.8 mttt -83.18 118.6 23.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.933 0.397 . . . . 10.0 110.761 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -133.91 144.48 48.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.748 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 38.9 tp -114.87 107.82 15.93 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -133.76 160.22 38.25 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.984 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -95.52 114.23 25.97 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 17.8 m -127.1 158.03 38.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.985 0.421 . . . . 10.0 110.587 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.478 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.2 p -97.35 126.05 42.34 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.032 0.444 . . . . 10.0 110.494 179.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -64.21 108.71 1.64 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.492 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.457 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.5 m-80 60.34 26.43 15.95 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.836 0.71 . . . . 10.0 110.267 -178.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 67.25 22.29 9.69 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.046 -0.979 . . . . 10.0 110.922 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.41 -75.35 0.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.062 -0.399 . . . . 10.0 111.429 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -98.86 118.78 62.38 Favored Pre-proline 0 C--N 1.33 -0.264 0 N-CA-C 111.71 0.263 . . . . 10.0 111.71 -178.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.478 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 61.7 Cg_endo -77.89 120.77 5.18 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.781 2.32 . . . . 10.0 111.514 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.425 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 21.1 ttmm -143.1 169.98 16.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . 0.425 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 22.4 m-85 -93.55 128.95 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.716 0.293 . . . . 10.0 110.556 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.439 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -141.43 132.39 26.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . 0.416 ' HB ' HD12 ' B' ' 27' ' ' LEU . 8.5 tt -110.71 122.07 64.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.257 0.551 . . . . 10.0 110.013 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.439 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.7 mtt85 -144.18 -179.74 6.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.209 -177.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.514 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -125.17 143.41 50.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.138 179.853 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -117.82 171.37 8.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.022 -0.536 . . . . 10.0 109.664 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -68.44 157.04 89.12 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -22.15 70.45 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.414 2.076 . . . . 10.0 111.859 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -100.72 0.07 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.13 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 58.34 30.05 19.02 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.075 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.1 -39.96 28.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.094 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -135.44 174.5 10.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 10.0 111.516 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -134.57 172.47 12.88 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.949 -1.023 . . . . 10.0 110.533 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.34 -161.95 9.01 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.127 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -99.44 147.08 25.65 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.989 -0.713 . . . . 10.0 112.142 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.98 -124.44 1.96 Allowed Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.144 -0.934 . . . . 10.0 110.777 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -145.82 146.46 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 117.556 0.678 . . . . 10.0 110.807 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.9 m -107.79 139.89 41.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.197 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.3 mt -124.25 132.29 53.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.234 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.23 166.78 22.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.179 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.26 -40.78 96.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.677 -0.238 . . . . 10.0 111.288 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.409 ' O ' HG21 ' B' ' 64' ' ' VAL . 9.4 pt-20 -63.76 -44.74 92.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.421 . . . . 10.0 110.511 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.452 ' OE2' ' HD2' ' A' ' 25' ' ' LYS . 36.1 mt-10 -66.47 -46.85 74.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.608 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.5 t80 -58.23 -39.26 78.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.438 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.61 -49.72 75.47 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.203 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.409 HG21 ' O ' ' B' ' 60' ' ' GLU . 8.2 t -66.5 -43.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.044 0.449 . . . . 10.0 110.432 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.3 tp -56.27 -54.73 41.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.887 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 48.9 mt -61.19 -47.82 84.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.126 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -50.49 -53.59 28.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.689 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 27.8 mm-40 -69.5 -47.17 64.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.844 -178.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.449 ' HB3' HD23 ' A' ' 66' ' ' LEU . 70.6 mt -60.13 -41.2 92.18 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.752 0.279 . . . . 10.0 111.752 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.21 -36.27 92.65 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.603 -0.808 . . . . 10.0 111.267 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -74.05 -29.66 62.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.077 0.465 . . . . 10.0 110.775 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 38.6 mmtt -65.56 -26.45 67.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.413 HD12 ' CB ' ' A' ' 66' ' ' LEU . 27.0 mt -89.44 3.24 52.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.694 0.283 . . . . 10.0 111.558 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.254 1.29 0 CA-C-O 118.567 -0.73 . . . . 10.0 110.105 179.694 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.8 mtm . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 120.879 0.371 . . . . 10.0 110.539 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.12 160.29 14.39 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.417 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 13.0 t70 -62.19 -57.32 11.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.417 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 39.1 mmtm -138.29 94.29 2.85 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.7 137.8 58.02 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.6 tppt? -71.75 134.29 46.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.148 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -159.58 170.12 22.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.006 179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.432 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.13 133.52 11.81 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.285 -0.416 . . . . 10.0 109.938 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 70.7 mt -80.74 110.48 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.107 0.479 . . . . 10.0 110.418 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.4 mm -82.8 -39.61 15.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.215 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -167.3 139.35 3.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.841 -179.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.15 137.08 32.93 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 53.1 mt -104.55 -76.01 0.61 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.488 -0.485 . . . . 10.0 110.828 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.433 HD13 ' O ' ' A' ' 13' ' ' LEU . 26.6 mm -134.92 134.22 53.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.222 0.534 . . . . 10.0 111.848 -178.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -114.63 121.93 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.504 HD13 ' HA ' ' B' ' 61' ' ' GLU . 32.0 mt -89.38 -80.67 0.3 Allowed 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.496 -0.482 . . . . 10.0 111.837 -177.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.2 m -179.64 -168.57 0.12 Allowed 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.293 0.371 . . . . 10.0 110.058 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.1 mp0 -110.49 146.33 36.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.435 ' CG ' ' H ' ' A' ' 20' ' ' ALA . 11.9 t-20 -89.55 -168.82 2.27 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.132 -0.692 . . . . 10.0 109.132 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.435 ' H ' ' CG ' ' A' ' 19' ' ' ASN . . . -64.28 -26.42 68.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.481 0.658 . . . . 10.0 111.006 -178.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -85.94 -0.14 54.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.218 -0.901 . . . . 10.0 110.837 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.25 2.98 90.37 Favored Glycine 0 N--CA 1.444 -0.773 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -58.56 108.89 0.69 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 111.467 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.5 tpp85 -79.96 108.93 13.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.17 178.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.549 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 61.5 mttt -88.89 109.82 20.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.194 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -133.28 149.3 51.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.627 0.727 . . . . 10.0 112.412 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.528 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 38.4 tp -122.36 108.54 13.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.518 -1.219 . . . . 10.0 107.882 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -134.16 166.28 23.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.304 0.574 . . . . 10.0 111.961 -177.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -98.71 114.33 26.8 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.6 m -128.71 156.83 41.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.761 0.315 . . . . 10.0 110.651 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.432 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.8 OUTLIER -93.51 123.91 37.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.252 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -64.4 108.82 1.73 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.784 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.408 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 60.74 30.3 19.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.932 -178.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t0 66.29 18.77 10.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.669 -1.151 . . . . 10.0 111.206 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.26 -93.1 0.28 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.599 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -84.94 126.59 67.61 Favored Pre-proline 0 C--O 1.233 0.22 0 CA-C-O 120.582 0.23 . . . . 10.0 111.593 -179.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.6 Cg_endo -81.0 120.42 3.76 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.042 2.495 . . . . 10.0 111.818 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -139.36 167.04 22.97 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -92.52 129.93 38.32 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.499 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t0 -139.88 132.94 29.53 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.892 -0.411 . . . . 10.0 109.892 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.416 ' HB ' ' CD1' ' A' ' 27' ' ' LEU . 13.7 tt -109.33 122.01 63.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.499 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.91 170.87 15.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.508 0.67 . . . . 10.0 112.103 -177.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.549 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.32 131.49 55.93 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 114.881 -1.054 . . . . 10.0 110.205 179.458 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -117.43 176.7 5.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.255 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.88 156.71 84.31 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -55.3 -37.5 94.47 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.729 2.286 . . . . 10.0 112.557 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -94.22 3.57 55.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.239 0.542 . . . . 10.0 110.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.8 m170 61.09 26.32 16.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.618 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.18 -35.06 77.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.728 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.4 mmtm -141.76 174.42 10.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.533 . . . . 10.0 111.291 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.88 172.29 11.84 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.457 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.93 -175.28 14.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.813 -0.708 . . . . 10.0 112.461 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -91.85 139.03 31.06 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.427 -0.455 . . . . 10.0 111.901 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -138.77 -121.2 1.9 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.369 -0.832 . . . . 10.0 111.174 179.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.3 tt -150.67 143.73 17.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.335 0.568 . . . . 10.0 111.012 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -104.39 135.59 45.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.53 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.8 mt -113.9 121.99 45.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.58 176.92 9.26 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.8 -0.36 . . . . 10.0 110.448 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.78 -41.5 91.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.192 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.473 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 13.4 pt-20 -56.14 -47.88 77.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.336 0.589 . . . . 10.0 110.739 178.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.528 ' CD ' ' HZ2' ' B' ' 25' ' ' LYS . 30.1 mt-10 -67.16 -60.18 2.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.329 -0.851 . . . . 10.0 111.663 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.595 ' CE2' HD12 ' A' ' 66' ' ' LEU . 5.1 t80 -48.29 -45.11 34.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.235 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.69 34.85 Favored Glycine 0 C--O 1.237 0.313 0 C-N-CA 121.389 -0.434 . . . . 10.0 113.264 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.9 t -69.58 -43.62 80.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.736 0.303 . . . . 10.0 111.419 -179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.96 -52.45 65.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.431 -178.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.595 HD12 ' CE2' ' A' ' 62' ' ' PHE . 17.3 mt -62.93 -46.15 89.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 120.788 -0.365 . . . . 10.0 111.465 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -52.32 -50.42 62.29 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.598 0.562 . . . . 10.0 110.906 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.661 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 34.6 mm-40 -70.55 -50.15 40.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.813 -0.631 . . . . 10.0 111.947 -179.045 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.406 ' HB3' HD22 ' B' ' 66' ' ' LEU . 64.6 mt -55.89 -47.49 77.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.574 0.226 . . . . 10.0 111.58 -179.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.93 -31.22 80.21 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.601 -0.809 . . . . 10.0 111.592 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -74.37 -32.85 62.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.64 0.257 . . . . 10.0 111.116 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.661 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 33.3 mmtt -70.22 -24.24 63.06 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.71 0.29 . . . . 10.0 110.971 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 22.5 mt -85.05 -6.46 59.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.113 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.442 -0.79 . . . . 10.0 110.634 -179.542 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.871 0.367 . . . . 10.0 110.23 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.82 163.82 14.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.4 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 11.4 t0 -68.93 -55.12 11.98 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.4 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 40.8 mmtm -137.94 93.24 2.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.934 178.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -63.91 139.82 58.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.376 . . . . 10.0 110.656 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -74.33 134.88 42.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.852 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -161.31 171.31 18.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.491 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -156.48 131.59 9.18 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -78.53 108.61 12.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.239 0.543 . . . . 10.0 110.534 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 24.5 mm -80.8 -40.52 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.936 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -166.79 138.91 3.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.621 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -84.22 139.63 32.23 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.4 mt -108.05 -73.42 0.69 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.433 -0.507 . . . . 10.0 111.274 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.467 HD13 ' HB3' ' A' ' 68' ' ' GLU . 14.7 mm -136.13 132.62 50.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.815 0.34 . . . . 10.0 111.761 -178.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.405 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -114.05 122.29 67.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 107.578 -1.268 . . . . 10.0 107.578 176.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.7 mt -88.31 -81.13 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.429 -0.509 . . . . 10.0 111.83 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 179.06 -169.21 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 11.5 mp0 -109.56 145.68 35.94 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.072 -0.344 . . . . 10.0 110.072 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . 0.411 ' CG ' ' H ' ' B' ' 20' ' ' ALA . 8.8 t-20 -88.09 -168.28 2.16 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . 0.411 ' H ' ' CG ' ' B' ' 19' ' ' ASN . . . -66.62 -22.27 66.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.192 0.52 . . . . 10.0 111.155 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -91.02 1.8 56.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 0.95 90.08 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.111 -0.796 . . . . 10.0 111.111 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.537 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -56.53 109.39 0.61 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.576 -0.312 . . . . 10.0 111.697 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.3 tpp85 -80.03 110.63 15.6 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.528 ' HZ2' ' CD ' ' A' ' 61' ' ' GLU . 61.0 mttt -90.04 110.86 21.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.394 -179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . 0.405 ' HG2' HG23 ' B' ' 15' ' ' VAL . 48.1 mt-10 -134.74 150.37 50.56 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.627 0.727 . . . . 10.0 112.333 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.511 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 35.3 tp -123.97 108.9 12.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.556 -1.202 . . . . 10.0 108.006 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -134.25 166.59 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.18 0.514 . . . . 10.0 111.828 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -98.05 113.75 25.72 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.32 -0.992 . . . . 10.0 108.32 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.5 m -128.74 155.46 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.887 0.375 . . . . 10.0 110.735 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -93.05 124.89 37.34 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.922 0.391 . . . . 10.0 110.584 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -64.44 109.32 1.9 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.689 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 60.3 29.9 19.39 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.539 0.685 . . . . 10.0 109.779 -178.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 41.7 t0 65.37 22.18 11.98 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.269 -1.332 . . . . 10.0 111.154 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.41 -89.18 0.38 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.488 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -88.79 125.9 61.32 Favored Pre-proline 0 C--O 1.235 0.302 0 CA-C-O 120.705 0.288 . . . . 10.0 111.426 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.4 Cg_endo -79.07 121.81 5.05 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.804 2.336 . . . . 10.0 111.582 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -140.49 164.31 30.47 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -90.75 127.68 36.41 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.511 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t0 -138.27 134.0 33.81 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 11.9 tt -110.21 120.95 62.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.511 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -143.9 169.84 17.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.543 0.687 . . . . 10.0 112.286 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.506 ' CG2' ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -113.21 131.13 56.01 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 114.838 -1.074 . . . . 10.0 110.356 179.467 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m0 -117.5 175.41 5.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.234 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.84 158.04 86.52 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -58.12 -33.02 96.94 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.529 2.152 . . . . 10.0 112.32 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -94.87 1.04 55.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.473 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 24.8 m170 62.28 24.27 14.43 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.284 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -66.99 -38.28 85.75 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.856 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -139.48 174.27 10.69 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.209 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.22 172.76 11.46 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.648 -178.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.9 -173.51 13.28 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.518 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 6.8 mtpp -93.64 136.31 34.05 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.243 -0.563 . . . . 10.0 111.863 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . 0.406 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -134.96 -123.01 2.29 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 110.65 -0.98 . . . . 10.0 110.65 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.3 tt -150.43 143.05 17.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.39 0.595 . . . . 10.0 110.798 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.96 134.58 46.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.731 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 46.7 mt -112.69 120.24 40.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.96 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.06 174.97 11.06 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.935 -0.306 . . . . 10.0 110.414 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -58.37 -42.6 87.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.54 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.491 ' O ' HG21 ' B' ' 64' ' ' VAL . 12.1 pt-20 -55.91 -43.83 77.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.387 0.613 . . . . 10.0 110.678 178.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.546 ' CD ' ' HZ2' ' A' ' 25' ' ' LYS . 31.3 mt-10 -70.94 -58.58 3.44 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.365 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.446 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 0.8 OUTLIER -52.74 -40.62 63.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.594 -178.425 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.27 -56.33 24.25 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.905 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.491 HG21 ' O ' ' B' ' 60' ' ' GLU . 13.5 t -68.24 -44.79 83.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.844 0.354 . . . . 10.0 111.366 -179.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.1 tp -57.12 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.531 -178.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 23.4 mt -60.1 -52.74 64.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.6 0.238 . . . . 10.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttm -49.05 -51.71 29.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.642 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.675 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 55.2 mm-40 -69.56 -51.31 36.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.124 -0.489 . . . . 10.0 112.092 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.435 ' HB3' HD23 ' A' ' 66' ' ' LEU . 62.4 mt -57.05 -46.16 82.66 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.701 0.26 . . . . 10.0 111.701 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.35 93.28 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.282 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . 0.401 ' HA ' ' HG3' ' B' ' 74' ' ' GLU . 2.0 t-20 -72.06 -30.83 65.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.58 -0.31 . . . . 10.0 111.688 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.675 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 13.9 mmtt -69.36 -25.48 64.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.541 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.412 ' CD1' ' HB3' ' A' ' 66' ' ' LEU . 19.1 mt -88.62 -2.76 58.76 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.384 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . 0.401 ' HG3' ' HA ' ' B' ' 71' ' ' ASN . 36.6 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.955 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.789 0.328 . . . . 10.0 110.426 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.47 163.53 13.37 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -72.28 -50.86 23.9 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.611 -0.514 . . . . 10.0 109.611 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -134.77 94.57 3.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.887 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.3 tp -68.46 140.53 55.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.463 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -74.53 131.47 41.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.616 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -158.03 171.83 19.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.393 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.412 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.27 135.19 12.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.346 -0.612 . . . . 10.0 109.346 178.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.403 ' HA ' HG12 ' A' ' 30' ' ' VAL . 65.1 mt -83.38 117.47 29.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 mm -84.95 -49.25 15.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.293 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -165.77 134.17 3.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.263 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -79.47 137.83 37.36 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.276 -0.638 . . . . 10.0 109.276 178.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 87.9 mt -105.75 -72.1 0.72 Allowed 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.793 -0.363 . . . . 10.0 111.467 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.467 HD11 ' O ' ' A' ' 13' ' ' LEU . 27.2 mm -131.75 140.86 47.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.094 0.474 . . . . 10.0 111.924 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.76 120.8 58.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 108.11 -1.07 . . . . 10.0 108.11 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.455 HD22 ' HB ' ' B' ' 64' ' ' VAL . 25.6 mt -91.02 -80.77 0.33 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.159 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.4 ' H ' ' HB2' ' A' ' 16' ' ' LEU . 3.4 m 179.36 -170.38 0.13 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 -179.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -106.67 140.08 40.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.817 0.341 . . . . 10.0 110.239 179.004 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -77.48 -174.63 3.43 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.01 -24.47 67.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.536 0.684 . . . . 10.0 110.837 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -90.21 3.02 54.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.155 -0.93 . . . . 10.0 110.692 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.06 6.01 87.01 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.207 -0.757 . . . . 10.0 111.207 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.433 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.6 m0 -62.1 100.33 0.16 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.839 0.352 . . . . 10.0 111.346 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 43' ' ' THR . 13.3 tpp85 -81.12 99.42 8.5 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HZ2' ' CD ' ' B' ' 61' ' ' GLU . 89.9 mttt -83.5 112.23 19.78 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.864 0.364 . . . . 10.0 110.52 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -131.55 149.31 52.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.842 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 38.3 tp -118.3 108.16 14.76 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.099 -1.075 . . . . 10.0 108.099 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -133.38 160.7 36.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 10.0 111.152 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -96.79 114.97 26.65 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' A' ' 9' ' ' ILE . 17.2 m -127.92 160.47 37.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.801 0.334 . . . . 10.0 110.569 -179.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.6 p -96.58 122.53 39.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.926 0.393 . . . . 10.0 110.453 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -64.2 109.97 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.014 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.488 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.2 m-80 59.12 31.0 20.91 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.781 0.676 . . . . 10.0 110.158 -178.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t70 61.61 30.06 18.47 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.763 -1.108 . . . . 10.0 110.959 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.75 -77.83 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.058 -0.402 . . . . 10.0 111.705 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -97.12 120.47 61.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 120.631 0.253 . . . . 10.0 111.589 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 69.0 Cg_endo -78.62 120.85 4.9 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.484 2.123 . . . . 10.0 111.325 178.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -141.25 168.5 19.62 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -93.26 130.47 38.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.437 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -141.54 130.02 22.56 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.4 tt -106.32 121.31 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.345 0.593 . . . . 10.0 109.953 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.437 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.65 177.6 8.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.19 -177.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.499 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -120.77 142.22 49.77 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.497 179.197 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -117.01 176.63 5.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.29 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.3 p -79.39 158.38 74.04 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -58.75 -30.86 93.75 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.53 2.153 . . . . 10.0 112.162 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -94.27 -5.35 46.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.834 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 60.83 34.59 19.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.6 -178.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -88.26 -32.51 18.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.472 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.0 mmtm -141.84 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.119 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.443 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -145.42 172.73 12.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.278 -177.701 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.63 -154.82 7.49 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.092 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.5 mttp -101.58 157.3 16.92 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 122.169 -0.607 . . . . 10.0 112.066 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.81 -122.36 0.99 Allowed Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.775 -0.93 . . . . 10.0 110.775 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -149.38 141.42 17.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 117.759 0.78 . . . . 10.0 111.367 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.51 144.67 31.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -129.79 130.66 45.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.113 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -84.97 175.21 9.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.774 -0.194 . . . . 10.0 110.905 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -53.69 -58.68 6.32 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.49 0.552 . . . . 10.0 112.49 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -57.69 -49.01 77.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.757 0.313 . . . . 10.0 111.829 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.484 ' CD ' ' HZ3' ' B' ' 25' ' ' LYS . 50.4 mt-10 -58.99 -49.0 79.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.204 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -62.62 -44.07 97.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.486 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.53 -54.56 36.21 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.101 -0.499 . . . . 10.0 112.917 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.2 -42.14 89.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.295 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -57.59 -53.06 62.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.462 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.437 HD21 ' HB3' ' B' ' 69' ' ' LEU . 17.2 mt -62.18 -46.14 90.26 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 -179.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -51.27 -51.35 54.99 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 123.635 0.584 . . . . 10.0 111.522 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 49.9 mm-40 -70.24 -46.69 63.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.339 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 69.0 mt -58.53 -44.15 89.47 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 111.682 0.253 . . . . 10.0 111.682 -179.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.57 -38.87 97.09 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.824 -0.703 . . . . 10.0 111.596 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -71.37 -29.05 64.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.813 0.34 . . . . 10.0 110.755 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 54.5 mmtt -66.55 -25.11 66.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.362 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.402 HD11 ' HB3' ' B' ' 66' ' ' LEU . 24.2 mt -85.68 -11.93 52.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.448 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.706 -0.664 . . . . 10.0 110.635 179.947 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.859 0.361 . . . . 10.0 110.446 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.01 160.57 16.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.401 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 14.8 t70 -72.22 -48.37 43.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.401 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 32.8 mmtm -135.05 94.46 3.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.66 -0.7 . . . . 10.0 109.546 179.006 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 26.9 tp -68.84 140.32 55.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.407 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.479 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -74.05 129.72 38.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.597 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -158.01 170.04 23.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.064 -0.517 . . . . 10.0 110.263 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.433 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 6.2 tp10 -152.63 133.05 13.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.506 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 63.7 mt -82.07 117.81 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.093 0.473 . . . . 10.0 110.124 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 39.5 mm -85.24 -50.82 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.377 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 -162.94 133.38 4.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.43 142.64 37.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.1 mt -112.43 -67.95 0.96 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.64 -0.424 . . . . 10.0 111.677 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.403 HG23 HD12 ' B' ' 14' ' ' ILE . 21.2 mm -133.03 141.38 44.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.826 0.346 . . . . 10.0 111.787 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -128.31 116.74 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 177.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 34.6 mt -86.14 -81.07 0.22 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.616 -177.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 178.99 -168.48 0.09 Allowed 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.473 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 0.8 OUTLIER -108.39 141.37 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.154 -0.313 . . . . 10.0 110.154 178.841 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -78.82 -172.76 3.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.25 66.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 10.0 110.879 -179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -93.24 2.74 56.5 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.376 -0.829 . . . . 10.0 110.198 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.43 5.5 84.86 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.664 -0.779 . . . . 10.0 111.436 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.473 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -61.33 101.61 0.18 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.867 0.365 . . . . 10.0 111.641 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.485 ' O ' ' HA ' ' B' ' 43' ' ' THR . 14.1 tpp85 -81.63 99.72 9.03 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.484 ' HZ3' ' CD ' ' A' ' 61' ' ' GLU . 90.5 mttt -83.46 113.6 20.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.974 0.416 . . . . 10.0 110.907 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -132.98 148.95 52.27 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.639 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.485 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 38.8 tp -119.3 107.62 13.62 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 178.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -133.18 161.33 34.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.968 0.413 . . . . 10.0 111.211 -177.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -97.7 114.68 26.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 23.0 m -127.28 159.92 36.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.518 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.477 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.2 p -95.01 122.85 38.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 10.0 110.775 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -64.27 110.45 2.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.783 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.479 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 65.1 m-80 59.43 29.26 18.8 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.23 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 64.11 24.81 13.58 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.834 -1.075 . . . . 10.0 110.903 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.9 -82.98 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.764 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -92.42 120.41 67.53 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 10.0 111.63 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.477 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.2 Cg_endo -76.84 124.05 7.22 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.617 2.212 . . . . 10.0 111.124 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -144.28 165.94 26.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -92.0 129.52 37.94 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.438 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -140.26 130.01 24.45 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 9.1 tt -105.53 121.59 57.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 10.0 109.951 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.438 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.9 mtt85 -145.04 176.85 9.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.398 -177.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -120.56 142.2 49.57 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.645 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -116.92 177.34 4.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.028 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -80.97 159.48 68.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.49 -28.79 88.37 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.385 2.056 . . . . 10.0 112.073 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.35 -5.75 42.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.641 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 62.53 28.35 16.68 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.984 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.55 -36.42 29.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.713 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -138.51 172.56 12.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.452 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' MET . . . . . 0.432 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -146.78 172.46 13.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.418 -177.761 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.82 -154.67 7.61 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.676 -0.773 . . . . 10.0 112.161 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.51 156.09 17.48 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 122.2 -0.588 . . . . 10.0 111.953 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.1 -121.17 1.11 Allowed Glycine 0 N--CA 1.452 -0.297 0 N-CA-C 110.761 -0.936 . . . . 10.0 110.761 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.416 HD11 HG21 ' B' ' 55' ' ' ILE . 12.2 tt -151.43 141.38 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 117.74 0.77 . . . . 10.0 111.166 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.96 145.67 29.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.591 -179.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 32.6 mt -128.95 128.83 44.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.272 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -83.57 173.36 11.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.696 -0.229 . . . . 10.0 110.867 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -51.86 -56.6 13.04 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.539 ' O ' HG22 ' B' ' 64' ' ' VAL . 11.5 pt-20 -60.53 -47.09 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.808 0.299 . . . . 10.0 111.808 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.485 ' CD ' ' HZ2' ' A' ' 25' ' ' LYS . 46.8 mt-10 -61.32 -47.44 85.93 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.38 . . . . 10.0 110.974 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -66.14 -40.12 90.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.807 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.07 -53.72 43.25 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.093 -0.503 . . . . 10.0 112.857 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.539 HG22 ' O ' ' B' ' 60' ' ' GLU . 14.1 t -62.31 -41.7 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 120.979 0.419 . . . . 10.0 110.119 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.2 tp -58.25 -52.44 65.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.453 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.45 HD23 ' HB3' ' A' ' 69' ' ' LEU . 49.6 mt -60.36 -48.71 80.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.331 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -50.34 -53.79 26.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 10.0 111.918 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 65.5 mm-40 -69.79 -47.32 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.015 -0.538 . . . . 10.0 111.933 -178.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.437 ' HB3' HD21 ' A' ' 66' ' ' LEU . 59.9 mt -59.91 -44.29 94.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.904 0.335 . . . . 10.0 111.904 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.16 -36.48 93.02 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.466 -0.873 . . . . 10.0 111.289 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.46 -28.39 61.02 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.699 0.285 . . . . 10.0 111.153 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.8 mmtt -65.45 -24.46 67.18 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 111.968 0.359 . . . . 10.0 111.968 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 23.2 mt -88.85 -4.28 58.52 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.722 -0.391 . . . . 10.0 111.53 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.644 -0.694 . . . . 10.0 110.116 179.35 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mmt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.976 0.417 . . . . 10.0 110.265 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.33 172.17 6.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.273 -0.421 . . . . 10.0 109.917 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.567 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 32.2 t70 -76.86 -57.0 4.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.011 0.434 . . . . 10.0 110.001 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 38.5 mmtm -135.42 95.38 3.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.873 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.52 141.76 58.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.801 0.334 . . . . 10.0 110.532 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -77.21 131.7 38.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.221 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -155.43 174.25 15.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.501 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.541 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.52 127.07 7.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.908 179.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 53.6 mt -81.54 111.81 18.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.141 0.496 . . . . 10.0 109.727 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.404 HG13 ' HB3' ' A' ' 37' ' ' PRO . 29.8 mm -80.28 -50.89 16.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.506 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -159.86 130.31 5.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.418 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -74.44 142.61 44.92 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 73.4 mt -110.64 -75.18 0.63 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.294 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.417 HD13 ' O ' ' A' ' 13' ' ' LEU . 27.8 mm -132.45 140.96 46.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.227 0.537 . . . . 10.0 112.146 -177.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.86 123.58 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 107.962 -1.125 . . . . 10.0 107.962 177.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.414 HD22 ' HB ' ' B' ' 64' ' ' VAL . 31.0 mt -94.65 -81.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.531 -0.468 . . . . 10.0 112.208 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 m -176.34 -168.38 0.25 Allowed 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.421 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -106.6 147.56 29.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.754 179.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -83.61 -172.78 4.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.19 -26.22 68.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.819 0.819 . . . . 10.0 109.911 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -88.67 -0.6 57.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.739 -1.118 . . . . 10.0 111.025 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.76 5.1 81.86 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.619 -0.8 . . . . 10.0 111.5 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.421 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -62.41 106.76 0.8 Allowed 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.866 0.365 . . . . 10.0 111.187 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.5 tpp85 -82.94 100.06 10.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.551 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.492 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 92.3 mttt -81.39 116.57 21.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.881 0.372 . . . . 10.0 110.56 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -132.97 152.24 51.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.084 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.525 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 46.3 tp -121.28 108.16 13.39 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 107.79 -1.189 . . . . 10.0 107.79 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -132.17 159.57 38.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 10.0 110.794 -178.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -96.9 113.65 25.2 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.284 -1.006 . . . . 10.0 108.284 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.4 m -127.37 158.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.776 0.322 . . . . 10.0 110.894 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.541 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -95.83 125.03 40.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.633 179.103 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.9 m0 -64.23 107.61 1.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.674 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.2 m-80 61.21 31.12 19.54 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.513 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.9 t0 66.33 17.08 10.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.056 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.82 -85.08 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.087 -0.383 . . . . 10.0 111.818 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -96.18 122.61 57.54 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 111.922 0.342 . . . . 10.0 111.922 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.7 Cg_endo -77.27 125.3 7.7 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.067 2.511 . . . . 10.0 111.676 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -143.35 167.98 20.88 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -93.96 126.38 39.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.209 -0.293 . . . . 10.0 110.209 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.448 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -138.27 133.2 32.81 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 14.5 tt -108.2 121.25 60.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.353 0.597 . . . . 10.0 109.956 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.448 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.44 -179.84 6.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.234 -177.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -123.73 145.38 49.05 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.688 179.267 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.5 m95 -117.48 168.44 10.38 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.96 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.1 m -66.79 157.74 82.68 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 178.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -51.7 -31.7 42.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.093 2.529 . . . . 10.0 113.28 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -107.5 11.92 28.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.226 0.536 . . . . 10.0 110.459 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 54.3 m80 59.03 25.36 13.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.949 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -73.84 -39.67 63.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.734 0.302 . . . . 10.0 111.084 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -133.51 175.42 9.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.316 0.579 . . . . 10.0 111.087 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -140.43 172.78 12.25 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.497 -178.31 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.44 -161.55 8.85 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.583 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -97.77 146.0 25.82 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 122.279 -0.542 . . . . 10.0 112.331 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.402 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -143.15 -126.99 2.08 Favored Glycine 0 CA--C 1.519 0.299 0 N-CA-C 111.097 -0.801 . . . . 10.0 111.097 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 tt -146.77 142.93 20.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 117.888 0.844 . . . . 10.0 111.519 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.0 144.66 30.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.785 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.1 mt -123.77 131.38 53.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.573 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.447 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 1.3 m -77.92 171.67 14.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.943 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -64.54 -46.54 82.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.506 0.193 . . . . 10.0 111.248 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.17 -43.8 95.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.231 0.539 . . . . 10.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' CD ' ' HG ' ' A' ' 58' ' ' SER . 74.0 mt-10 -65.28 -52.66 52.8 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.113 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.597 ' CE2' HD13 ' A' ' 66' ' ' LEU . 21.1 t80 -56.25 -43.72 78.98 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.343 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.68 -54.11 39.75 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.14 -0.552 . . . . 10.0 112.729 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 89.4 t -62.22 -42.47 95.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.768 0.318 . . . . 10.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.445 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 14.9 tp -58.53 -52.58 65.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.402 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.597 HD13 ' CE2' ' A' ' 62' ' ' PHE . 19.4 mt -61.87 -46.05 91.13 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.483 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -51.54 -52.82 43.93 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 123.456 0.473 . . . . 10.0 111.194 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 70.6 mm-40 -68.68 -46.75 68.23 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.711 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 79.9 mt -60.14 -43.67 95.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.683 0.277 . . . . 10.0 111.411 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.61 -33.99 88.73 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.72 -0.753 . . . . 10.0 111.346 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -73.98 -28.37 61.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.882 0.373 . . . . 10.0 110.786 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.64 -27.5 66.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.967 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.0 mt -90.0 -5.25 56.85 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.735 0.272 . . . . 10.0 111.735 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.656 -0.687 . . . . 10.0 110.665 -179.705 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.931 0.396 . . . . 10.0 109.976 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.53 168.18 9.43 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.429 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 36.1 t70 -76.49 -53.32 8.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.055 0.455 . . . . 10.0 110.078 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.429 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 38.2 mmtm -136.29 94.54 3.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.685 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.6 tp -65.4 139.26 58.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.856 0.36 . . . . 10.0 110.602 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.478 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.2 tppt? -75.58 130.69 39.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.57 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -153.94 174.3 14.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.196 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.516 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.8 tp10 -155.11 122.37 5.56 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.806 179.097 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . 0.454 ' HA ' HG12 ' B' ' 30' ' ' VAL . 44.7 mt -77.65 109.83 12.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 28.6 mm -79.01 -51.83 16.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.664 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -158.87 127.97 5.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.265 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -72.26 145.06 48.16 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 53.1 mt -113.29 -72.12 0.72 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.488 -179.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 18.9 mm -133.17 140.63 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 10.0 112.052 -177.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.6 p -123.48 123.77 68.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 107.969 -1.123 . . . . 10.0 107.969 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 30.5 mt -94.92 -81.19 0.4 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.473 -0.491 . . . . 10.0 112.012 -177.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.46 -168.42 0.15 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 -179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.424 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -106.87 147.57 29.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 10.0 110.271 179.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -83.69 -168.0 1.94 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.141 -0.482 . . . . 10.0 109.75 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.1 -23.45 64.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.282 0.563 . . . . 10.0 110.356 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -91.78 1.03 57.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.419 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.82 4.66 82.19 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.51 -0.852 . . . . 10.0 111.636 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -61.94 106.16 0.67 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.742 0.306 . . . . 10.0 110.973 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.476 ' O ' ' HA ' ' B' ' 43' ' ' THR . 7.9 tpp85 -83.02 100.43 10.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.809 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.443 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 93.3 mttt -81.03 116.97 21.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 10.0 110.891 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -132.57 150.39 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.937 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.493 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 41.2 tp -120.14 107.94 13.63 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.95 -1.13 . . . . 10.0 107.95 178.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -133.27 158.0 44.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.939 0.4 . . . . 10.0 111.159 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -94.93 114.0 25.79 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.414 -0.958 . . . . 10.0 108.414 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.454 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.2 m -128.16 156.15 40.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.362 . . . . 10.0 110.883 -178.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.516 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.7 OUTLIER -95.11 125.58 39.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.033 0.444 . . . . 10.0 110.626 179.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 10.5 m0 -64.24 110.11 2.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.956 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.478 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.7 m-80 60.6 28.71 18.41 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.667 0.604 . . . . 10.0 110.356 -178.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 40.4 t0 62.66 32.22 16.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.037 -0.983 . . . . 10.0 110.214 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.62 -82.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.025 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -98.16 122.38 54.35 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-O 120.646 0.26 . . . . 10.0 111.515 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 70.3 Cg_endo -77.12 121.78 5.92 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.809 2.339 . . . . 10.0 111.654 178.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -139.75 167.5 21.96 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -95.04 126.83 40.65 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.463 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -138.15 132.82 32.52 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.611 -0.515 . . . . 10.0 109.611 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . 0.411 HG22 HD12 ' B' ' 41' ' ' ILE . 11.9 tt -106.44 121.76 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.183 0.516 . . . . 10.0 109.73 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.463 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -144.87 178.48 7.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.268 0.556 . . . . 10.0 111.599 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -121.86 145.0 48.51 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.573 -0.739 . . . . 10.0 109.743 179.453 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -117.73 167.09 11.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.673 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 16.6 m -66.35 157.98 79.69 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.504 -0.554 . . . . 10.0 109.504 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -51.48 -33.24 46.48 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.975 2.45 . . . . 10.0 112.908 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -105.1 11.29 33.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.102 0.477 . . . . 10.0 110.91 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.2 m80 57.76 27.66 14.75 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.38 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.23 -39.85 59.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.825 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -134.68 175.17 9.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 10.0 111.132 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' MET . . . . . 0.423 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -141.19 172.63 12.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.257 -0.883 . . . . 10.0 110.363 -178.111 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.63 -159.97 8.25 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.566 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -97.41 146.47 25.16 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.184 -0.598 . . . . 10.0 112.241 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.4 -129.02 2.34 Favored Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -147.48 140.9 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 117.666 0.733 . . . . 10.0 111.22 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.83 147.92 25.54 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.16 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 87.6 mt -126.52 132.94 51.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.383 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' SER . . . . . 0.409 ' HG ' ' CD ' ' B' ' 61' ' ' GLU . 1.3 m -79.92 169.52 17.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.27 -47.95 83.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 10.0 111.145 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.653 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.5 pt-20 -58.57 -44.31 89.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.608 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.419 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 65.6 mt-10 -66.48 -52.73 43.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.023 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.477 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.1 t80 -57.16 -41.56 79.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.858 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.75 -53.46 45.79 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.27 -0.491 . . . . 10.0 112.84 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.653 HG23 ' O ' ' B' ' 60' ' ' GLU . 15.6 t -62.97 -43.51 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.877 0.37 . . . . 10.0 110.503 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.1 tp -58.33 -51.98 67.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.358 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 62.1 mt -60.1 -49.61 76.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.812 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -50.74 -54.62 21.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.661 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 39.6 mm-40 -67.42 -47.57 69.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.053 -0.521 . . . . 10.0 112.027 -178.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.44 ' HB3' HD22 ' A' ' 66' ' ' LEU . 72.5 mt -61.75 -42.12 98.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.5 0.19 . . . . 10.0 111.455 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.73 -37.37 94.71 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -72.02 -28.81 63.62 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.023 0.44 . . . . 10.0 110.911 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.5 mmtt -64.44 -32.27 73.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.065 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 24.9 mt -90.66 6.06 45.49 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.794 -0.622 . . . . 10.0 109.788 179.209 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 mmt . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 120.889 0.376 . . . . 10.0 110.175 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 168.29 10.45 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.115 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.96 -58.22 3.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -135.95 105.19 5.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.0 tp -78.26 143.28 37.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 10.0 110.423 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -78.63 139.41 38.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.968 0.413 . . . . 10.0 111.268 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 p90 -162.84 175.92 10.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.608 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.426 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.9 tp10 -160.13 131.14 5.73 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.8 mt -80.38 112.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.785 0.326 . . . . 10.0 110.208 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.2 mm -85.48 -39.47 13.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.657 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -165.8 127.25 1.91 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.571 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.55 142.63 37.2 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 178.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 72.2 mt -111.43 -74.47 0.64 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.559 -0.457 . . . . 10.0 111.627 -178.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 28.1 mm -129.41 144.57 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.143 0.497 . . . . 10.0 111.855 -177.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.56 126.52 65.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.462 HD21 ' HB ' ' B' ' 64' ' ' VAL . 36.0 mt -95.33 -80.57 0.41 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.704 -0.398 . . . . 10.0 111.249 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 m 175.82 -173.93 0.09 Allowed 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.378 0.671 . . . . 10.0 109.487 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.492 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -99.58 151.86 20.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.293 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.405 ' CG ' ' H ' ' A' ' 20' ' ' ALA . 14.5 t-20 -94.18 -173.33 3.06 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.405 ' H ' ' CG ' ' A' ' 19' ' ' ASN . . . -61.07 -26.4 67.61 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.639 0.733 . . . . 10.0 110.811 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -89.17 3.09 53.09 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.022 -0.99 . . . . 10.0 110.719 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.36 -1.54 88.55 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.817 -0.706 . . . . 10.0 111.466 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.492 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.2 m0 -56.13 107.05 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.987 0.366 . . . . 10.0 111.987 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 tpp85 -80.18 108.74 14.03 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.518 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 78.9 mttt -85.46 112.0 20.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.292 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -138.59 155.44 48.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.667 0.746 . . . . 10.0 112.122 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 36.4 tp -127.7 110.4 12.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.668 -1.151 . . . . 10.0 108.393 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.04 162.77 31.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.05 0.453 . . . . 10.0 111.795 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -94.84 114.72 26.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 178.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.4 m -129.54 156.74 42.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.974 0.416 . . . . 10.0 111.246 -179.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.5 p -96.83 122.3 39.65 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.04 0.447 . . . . 10.0 110.627 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -63.92 111.23 2.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.962 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 58.93 27.97 16.95 Favored 'General case' 0 N--CA 1.463 0.179 0 O-C-N 123.806 0.691 . . . . 10.0 110.44 -178.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.1 t70 64.76 25.64 12.97 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.232 -0.895 . . . . 10.0 110.891 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.69 -80.22 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.335 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -98.32 123.74 49.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.541 0.21 . . . . 10.0 111.41 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 74.4 Cg_endo -81.05 123.86 4.72 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.997 2.464 . . . . 10.0 111.685 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -143.85 168.69 19.35 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.87 136.77 32.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.58 129.33 15.18 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.1 tt -108.73 122.62 63.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.251 0.548 . . . . 10.0 109.579 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.442 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.1 mtt85 -146.45 176.16 10.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.42 0.629 . . . . 10.0 111.977 -177.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.518 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -117.38 131.28 56.8 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 114.799 -1.091 . . . . 10.0 109.718 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.0 m0 -117.26 177.52 4.7 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.757 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -72.96 155.39 90.52 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.57 -24.07 70.19 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.195 1.93 . . . . 10.0 112.068 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -98.05 -0.86 43.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.861 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.2 m170 61.34 20.88 11.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.405 -0.816 . . . . 10.0 110.703 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -71.7 -39.34 70.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.033 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -135.35 174.3 10.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.224 0.535 . . . . 10.0 111.194 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.74 171.79 13.61 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.183 -0.917 . . . . 10.0 110.407 -177.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.91 -161.74 8.99 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.637 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.5 mttp -99.94 145.87 27.33 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -145.41 -121.01 1.38 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 111.08 -0.808 . . . . 10.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.425 HG21 HD11 ' A' ' 55' ' ' ILE . 12.7 tt -148.84 142.55 18.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.521 0.66 . . . . 10.0 111.14 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -101.73 136.84 40.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.833 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.4 mt -117.09 120.48 38.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.925 0.393 . . . . 10.0 110.27 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.465 ' HB3' ' HG2' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -80.6 172.49 13.69 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.502 179.586 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -58.22 -43.05 87.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 10.0 111.503 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.528 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.2 pt-20 -54.44 -47.38 72.95 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.39 0.614 . . . . 10.0 110.509 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.528 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 26.7 mt-10 -68.23 -58.64 4.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.052 -0.977 . . . . 10.0 111.326 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.698 ' CE2' HD11 ' A' ' 66' ' ' LEU . 10.1 t80 -49.82 -44.83 49.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.401 -0.818 . . . . 10.0 111.867 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.87 -58.5 13.42 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.229 -0.51 . . . . 10.0 113.181 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -65.17 -40.93 90.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.883 0.373 . . . . 10.0 111.296 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.459 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.1 tp -58.24 -53.84 53.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.958 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.698 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.1 mt -61.92 -43.84 98.01 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.106 -0.237 . . . . 10.0 111.356 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.1 tttm -50.76 -53.31 32.75 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 123.616 0.572 . . . . 10.0 111.07 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 25.2 mm-40 -72.07 -44.56 63.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.706 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 44.0 mt -59.43 -44.0 92.98 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.424 0.157 . . . . 10.0 111.424 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.4 94.67 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.459 -0.876 . . . . 10.0 110.987 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.75 -28.15 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.702 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 72.3 mmtt -68.54 -30.7 69.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.285 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.4 mt -88.49 2.56 52.62 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.243 -0.183 . . . . 10.0 111.419 -179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.471 -0.776 . . . . 10.0 110.309 179.857 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.3 mmt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.915 0.388 . . . . 10.0 110.18 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.24 163.47 13.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.322 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.404 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 4.6 t70 -66.32 -60.37 2.83 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.404 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 35.1 mmtm -132.5 104.64 6.79 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 37.3 tp -77.56 142.71 38.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.814 0.34 . . . . 10.0 110.692 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -79.36 136.27 36.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.078 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -160.11 174.77 13.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.681 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.436 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 13.5 tp10 -158.64 126.57 5.14 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.059 -0.348 . . . . 10.0 110.059 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 71.9 mt -76.0 114.55 16.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.064 0.459 . . . . 10.0 110.156 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 32.0 mm -86.99 -41.26 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.428 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -164.48 127.53 2.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.771 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -76.52 142.89 40.72 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.4 mt -111.75 -72.55 0.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.521 -0.472 . . . . 10.0 111.861 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.434 HD11 ' CB ' ' A' ' 68' ' ' GLU . 21.5 mm -131.5 144.2 38.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 10.0 111.496 -177.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -129.16 123.36 58.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 177.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 26.5 mt -92.3 -80.81 0.36 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.905 -0.318 . . . . 10.0 111.445 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 176.59 -172.05 0.09 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.302 0.641 . . . . 10.0 109.386 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.448 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.9 mp0 -101.34 150.87 22.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . 0.434 ' CG ' ' H ' ' B' ' 20' ' ' ALA . 18.0 t-20 -90.91 -174.51 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.781 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . 0.434 ' H ' ' CG ' ' B' ' 19' ' ' ASN . . . -63.82 -23.83 67.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.453 0.644 . . . . 10.0 110.596 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -91.06 1.49 57.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.287 -0.869 . . . . 10.0 110.314 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.34 -1.21 87.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.389 -178.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.5 ' HB3' ' CG2' ' B' ' 43' ' ' THR . 40.3 m0 -56.68 107.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.61 109.58 15.27 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . 0.424 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 80.8 mttt -86.36 111.58 20.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.611 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.21 157.14 46.88 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.568 0.699 . . . . 10.0 112.138 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 35.4 tp -128.88 111.02 12.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.742 -1.117 . . . . 10.0 108.192 178.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -135.57 161.03 36.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.037 0.446 . . . . 10.0 111.435 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 ttm-85 -93.03 114.67 27.29 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.35 -0.981 . . . . 10.0 108.35 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 18.3 m -128.87 154.99 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.948 0.404 . . . . 10.0 111.076 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.5 p -95.63 122.72 38.69 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.972 0.415 . . . . 10.0 110.513 179.226 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -63.99 112.39 2.93 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.82 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 57.58 28.13 15.18 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.708 0.63 . . . . 10.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 62.95 30.45 16.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.963 -1.017 . . . . 10.0 110.884 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.77 -79.07 0.58 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.102 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -99.05 122.06 53.66 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.532 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 65.7 Cg_endo -79.78 122.52 4.94 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.716 2.277 . . . . 10.0 111.709 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -142.99 166.57 24.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -87.41 135.65 33.25 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.5 t0 -147.41 128.57 14.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 10.1 tt -107.34 123.25 62.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.423 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -146.23 175.05 10.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.494 0.664 . . . . 10.0 112.119 -177.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.5 ' CG2' ' HB3' ' B' ' 23' ' ' TRP . 0.0 OUTLIER -117.45 131.59 56.71 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.728 -1.124 . . . . 10.0 109.887 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 18.0 m0 -117.56 177.99 4.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.56 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.9 m -74.21 155.44 88.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.17 -31.21 89.87 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.073 1.849 . . . . 10.0 112.145 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.14 -3.8 57.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.195 179.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 m170 64.15 24.7 13.52 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.489 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.68 -39.64 61.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.138 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -133.97 174.3 10.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.136 0.493 . . . . 10.0 110.834 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.74 168.82 18.94 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.573 -177.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.04 -163.79 10.23 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.704 -0.76 . . . . 10.0 112.664 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mttp -98.59 144.84 27.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.38 0.511 . . . . 10.0 112.38 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.52 -118.54 1.31 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.8 tt -152.56 142.35 14.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.413 0.607 . . . . 10.0 110.919 179.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.6 m -102.44 135.42 44.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.475 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 68.8 mt -115.75 121.23 41.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.871 0.367 . . . . 10.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.9 m -80.45 174.01 12.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.582 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -59.26 -40.78 87.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.838 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.508 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 8.5 pt-20 -55.55 -46.67 77.11 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.606 0.717 . . . . 10.0 110.432 178.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.508 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 31.6 mt-10 -68.54 -58.62 4.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.021 -0.991 . . . . 10.0 111.202 -179.226 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.4 ' CE2' HD13 ' B' ' 66' ' ' LEU . 1.0 OUTLIER -53.83 -39.18 65.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.822 -178.529 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.32 -59.65 9.59 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.918 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.462 ' HB ' HD21 ' A' ' 16' ' ' LEU . 8.9 t -67.19 -41.04 86.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.627 0.251 . . . . 10.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.58 -53.59 56.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.094 -179.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.4 HD13 ' CE2' ' B' ' 62' ' ' PHE . 45.3 mt -59.01 -49.12 79.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.238 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -50.19 -54.19 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.662 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 21.7 mm-40 -69.38 -46.53 66.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.856 -0.611 . . . . 10.0 112.056 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.445 ' HB3' HD23 ' A' ' 66' ' ' LEU . 46.8 mt -60.57 -43.86 96.82 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.127 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.04 94.11 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.717 -0.953 . . . . 10.0 110.717 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.19 -23.6 61.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.365 -0.418 . . . . 10.0 111.185 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.6 mmtt -70.06 -29.82 66.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.185 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 21.5 mt -90.31 4.52 50.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.563 0.22 . . . . 10.0 111.411 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.907 -0.568 . . . . 10.0 109.866 179.071 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.6 mmm . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 120.869 0.366 . . . . 10.0 110.228 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.44 154.68 18.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.903 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.467 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 24.3 t70 -60.15 -52.8 63.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.124 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.467 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 24.4 mmtm -137.8 106.41 5.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.859 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.0 tp -82.93 137.3 34.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.081 -0.34 . . . . 10.0 110.081 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -73.23 134.52 44.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.279 -0.418 . . . . 10.0 110.889 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -159.83 168.29 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.257 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.501 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.5 tp10 -147.49 135.22 21.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.145 178.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.68 106.69 14.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.433 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.414 HG13 ' HB3' ' A' ' 37' ' ' PRO . 37.2 mm -77.11 -56.51 7.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.937 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -157.83 126.79 5.71 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.062 -179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -73.46 142.61 46.85 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.1 mt -110.69 -75.65 0.62 Allowed 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.368 -0.533 . . . . 10.0 111.539 -178.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.447 HD13 ' O ' ' A' ' 13' ' ' LEU . 29.9 mm -131.03 136.95 56.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.162 0.506 . . . . 10.0 111.741 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -117.23 123.18 71.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.246 -1.02 . . . . 10.0 108.246 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -90.45 -80.87 0.32 Allowed 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.764 -0.374 . . . . 10.0 111.308 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.3 m 176.59 -179.13 0.17 Allowed 'General case' 0 C--O 1.235 0.34 0 C-N-CA 122.952 0.501 . . . . 10.0 110.006 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 45.1 mp0 -95.09 164.46 12.86 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.02 -167.69 1.25 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.307 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.48 -25.71 68.14 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 10.0 110.556 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -91.56 0.24 57.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.146 -0.933 . . . . 10.0 110.728 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 -1.56 88.57 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.811 -0.709 . . . . 10.0 111.492 -178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.508 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.0 m0 -53.05 105.64 0.13 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.558 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.0 tpp85 -80.37 100.16 8.3 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 178.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -81.57 112.02 18.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.675 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -137.98 152.4 48.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.372 0.606 . . . . 10.0 111.58 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.517 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 34.2 tp -122.99 107.65 12.05 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -134.28 157.76 45.5 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.478 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -97.12 114.32 25.99 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.7 m -125.41 162.04 28.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.795 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.501 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -98.78 123.97 43.36 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.95 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -64.28 112.28 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.982 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.6 m-80 58.72 28.93 17.96 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.681 0.613 . . . . 10.0 110.447 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.7 t70 64.23 27.69 13.91 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.128 -0.942 . . . . 10.0 110.648 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.47 -82.61 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.366 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -89.19 120.5 69.82 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.556 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 33.8 Cg_endo -82.93 120.64 3.06 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.664 2.243 . . . . 10.0 111.111 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.424 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 16.3 ttpt -148.19 160.73 42.63 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.216 -0.29 . . . . 10.0 110.216 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -81.63 140.0 34.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.628 -0.26 . . . . 10.0 110.692 -178.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.405 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -150.4 133.9 16.49 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 10.6 tt -111.86 122.75 66.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.118 0.485 . . . . 10.0 109.92 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.405 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.4 mtt85 -148.14 171.19 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.495 -177.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.558 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.7 p -121.31 134.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -118.76 177.97 4.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.541 0.21 . . . . 10.0 110.872 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.7 m -63.38 151.81 86.59 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.837 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.04 -30.73 83.27 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.528 2.152 . . . . 10.0 111.88 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -91.11 -3.03 57.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.253 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 64.25 24.83 13.44 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.716 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.37 -34.05 61.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.008 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -141.33 174.45 10.53 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.347 0.594 . . . . 10.0 111.722 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.93 172.62 10.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.761 -1.109 . . . . 10.0 110.944 -178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -140.58 -171.71 12.6 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 121.062 -0.59 . . . . 10.0 112.475 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.8 mttp -99.0 144.33 28.28 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 121.979 -0.718 . . . . 10.0 112.446 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.59 -120.38 1.47 Allowed Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.577 -1.009 . . . . 10.0 110.577 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -149.18 142.65 18.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 117.513 0.656 . . . . 10.0 110.818 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.2 m -97.47 139.79 32.88 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.973 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.7 mt -115.8 118.77 33.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.913 0.387 . . . . 10.0 110.594 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -77.5 167.28 21.91 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.8 -39.88 86.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.779 0.323 . . . . 10.0 110.399 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 61' ' ' GLU . 6.7 pt-20 -56.63 -46.93 80.68 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.253 178.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.411 ' H ' ' HG3' ' A' ' 60' ' ' GLU . 31.5 mt-10 -67.81 -56.37 9.42 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.786 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.667 ' CE2' HD11 ' A' ' 66' ' ' LEU . 7.8 t80 -49.72 -47.95 50.29 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.029 0.831 . . . . 10.0 111.776 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.94 -56.46 25.19 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.39 -0.433 . . . . 10.0 113.382 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.1 t -67.28 -42.33 87.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.82 0.343 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 17.5 tp -58.53 -53.38 58.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.016 -178.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.667 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.2 mt -61.26 -44.41 97.28 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.38 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.7 tttm -52.19 -53.49 42.69 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.046 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.609 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 54.5 mm-40 -70.09 -47.88 59.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.702 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.492 ' HB3' HD21 ' B' ' 66' ' ' LEU . 59.0 mt -58.27 -45.46 87.83 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.633 0.234 . . . . 10.0 111.633 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.3 -35.04 91.46 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.565 -0.826 . . . . 10.0 111.396 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -73.48 -28.72 62.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.491 -0.354 . . . . 10.0 110.859 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.609 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 52.1 mmtt -68.88 -23.4 64.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.986 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.3 mt -89.86 -14.35 34.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.868 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.851 -0.595 . . . . 10.0 110.462 -179.642 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 31.9 mmm . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.689 0.28 . . . . 10.0 110.605 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.72 161.04 13.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' ASP . . . . . 0.431 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 23.2 t70 -66.79 -52.73 40.54 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 31.6 mmtm -136.98 104.95 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.031 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 37.4 tp -82.18 133.67 35.27 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 179.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.452 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.8 tppt? -72.47 133.14 44.69 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.072 0.463 . . . . 10.0 111.282 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -158.35 170.02 23.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.554 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . 0.474 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.0 tp10 -147.32 133.64 19.55 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 50.9 mt -81.63 105.0 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.98 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 47.3 mm -75.34 -56.93 7.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.071 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -157.58 130.33 7.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.981 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.92 141.31 40.56 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.922 -0.77 . . . . 10.0 108.922 178.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 44.0 mt -110.27 -74.09 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.439 -0.504 . . . . 10.0 111.664 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 19.5 mm -130.29 136.79 57.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.046 0.45 . . . . 10.0 111.714 -177.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.456 HG21 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -118.48 120.45 64.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -87.43 -81.15 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.719 -0.392 . . . . 10.0 111.41 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m 176.07 -177.99 0.13 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.017 0.527 . . . . 10.0 109.922 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 36.7 mp0 -96.81 163.92 12.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.15 -166.61 1.13 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.461 -0.2 . . . . 10.0 110.461 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.85 -26.76 68.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.388 0.613 . . . . 10.0 110.89 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -92.04 0.41 57.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.322 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.51 -0.23 89.7 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.632 -0.794 . . . . 10.0 111.666 -178.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' TRP . . . . . 0.513 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -52.72 106.28 0.15 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 112.03 0.382 . . . . 10.0 112.03 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.3 tpp85 -80.59 100.25 8.52 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -81.59 112.19 18.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.755 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . 0.456 ' HG2' HG21 ' B' ' 15' ' ' VAL . 53.8 mt-10 -138.21 152.94 49.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.387 0.613 . . . . 10.0 111.811 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.475 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 36.8 tp -123.08 107.56 11.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.008 -1.108 . . . . 10.0 108.008 178.278 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -134.45 157.28 46.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.565 -0.289 . . . . 10.0 110.714 -178.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -96.67 114.97 26.66 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 19.4 m -126.69 160.99 34.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.665 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.474 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -97.28 124.54 41.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.079 0.466 . . . . 10.0 111.094 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -64.46 111.75 2.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.008 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.452 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.4 m-80 58.4 30.63 19.9 Favored 'General case' 0 CA--C 1.521 -0.139 0 O-C-N 123.802 0.689 . . . . 10.0 110.361 -178.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.4 t0 61.0 33.01 19.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.986 -1.006 . . . . 10.0 110.565 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.46 -78.72 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.923 -0.58 . . . . 10.0 111.289 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -92.41 117.55 67.68 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.432 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.4 Cg_endo -81.0 119.98 3.67 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.592 2.195 . . . . 10.0 111.279 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ttpt -148.36 161.62 41.2 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.035 -0.266 . . . . 10.0 110.436 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -81.17 139.53 35.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.876 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.404 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -150.71 132.61 15.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' ILE . . . . . 0.431 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.8 tt -110.25 122.87 65.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-O 121.246 0.546 . . . . 10.0 110.193 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.404 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.1 mtt85 -147.88 170.58 17.35 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.661 -177.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.5 p -120.53 134.17 55.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m0 -118.03 177.75 4.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.789 -0.187 . . . . 10.0 110.973 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -66.11 151.04 96.15 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.675 -0.239 . . . . 10.0 110.372 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.61 -33.34 96.81 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.569 2.18 . . . . 10.0 111.793 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -87.15 -5.03 59.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.289 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 66.48 21.0 10.87 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.586 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -70.49 -37.87 74.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.956 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -137.79 174.17 10.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.495 0.664 . . . . 10.0 112.293 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.58 172.09 11.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.743 -1.117 . . . . 10.0 110.72 -178.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -140.14 -170.18 11.92 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 121.034 -0.603 . . . . 10.0 112.248 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -99.7 142.2 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.987 -0.714 . . . . 10.0 112.53 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -140.01 -120.64 1.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 110.209 -1.156 . . . . 10.0 110.209 179.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.3 tt -150.06 143.26 17.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.413 0.607 . . . . 10.0 110.565 179.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m -97.0 140.0 32.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.271 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -116.5 117.71 30.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.845 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -76.22 166.67 23.13 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.22 -39.24 85.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 10.0 110.166 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' B' ' 61' ' ' GLU . 7.0 pt-20 -56.88 -44.98 82.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.44 -0.8 . . . . 10.0 110.381 177.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' B' ' 60' ' ' GLU . 33.8 mt-10 -69.63 -56.37 7.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.454 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.54 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.2 t80 -52.25 -44.5 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.82 0.7 . . . . 10.0 111.332 -179.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.81 -55.44 30.85 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.907 -0.663 . . . . 10.0 113.128 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.8 t -68.99 -44.18 81.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.895 0.378 . . . . 10.0 111.228 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.25 -52.45 65.27 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.007 -178.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 29.8 mt -59.03 -50.75 72.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.775 0.322 . . . . 10.0 110.742 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -50.08 -55.33 15.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.934 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 40.6 mm-40 -67.95 -49.67 60.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.983 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.413 ' HB3' HD21 ' A' ' 66' ' ' LEU . 64.7 mt -58.86 -45.4 90.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.613 0.227 . . . . 10.0 111.613 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.64 -36.72 93.65 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.616 -0.802 . . . . 10.0 111.15 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -73.59 -28.02 61.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.938 0.399 . . . . 10.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.4 mmtt -66.81 -25.93 66.69 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.87 0.367 . . . . 10.0 110.689 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 21.5 mt -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.313 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.77 -0.633 . . . . 10.0 110.205 179.739 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.8 mmm . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 121.001 0.429 . . . . 10.0 110.084 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.06 160.16 25.91 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.383 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -64.16 -49.41 72.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 10.0 110.25 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -134.55 108.32 8.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.098 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.534 ' CG ' ' H72' ' C' ' 4' ' ' ' DT' . 32.6 tp -82.77 134.7 35.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.095 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -70.31 139.18 52.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.93 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.495 ' HB3' ' H73' ' C' ' 4' ' ' ' DT' . 13.5 p90 -166.57 175.08 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.488 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -158.51 134.01 8.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 52.2 mt -80.79 111.82 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.9 mm -83.4 -45.96 18.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.591 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -159.31 132.43 7.04 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.107 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.0 127.44 33.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 75.9 mt -99.99 -74.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.474 -0.49 . . . . 10.0 111.931 -178.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.44 HD12 ' O ' ' A' ' 13' ' ' LEU . 29.2 mm -130.09 144.16 38.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.086 0.469 . . . . 10.0 112.212 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.3 p -124.48 123.86 67.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.324 -0.991 . . . . 10.0 108.324 177.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.2 mt -91.02 -80.36 0.34 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.366 -0.534 . . . . 10.0 111.046 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 175.51 -177.42 0.11 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.086 0.554 . . . . 10.0 109.782 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.487 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 36.4 mp0 -97.26 164.08 12.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.38 -166.4 1.08 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.489 ' O ' ' H71' ' C' ' 1' ' ' ' DT' . . . -63.88 -29.23 70.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.395 0.617 . . . . 10.0 109.874 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -87.91 -1.84 58.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.21 -0.905 . . . . 10.0 110.309 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.64 0.15 89.23 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.672 -0.775 . . . . 10.0 112.041 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.487 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.6 m0 -52.95 107.07 0.19 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 122.493 0.317 . . . . 10.0 111.794 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.552 ' O ' ' HA ' ' A' ' 43' ' ' THR . 14.7 tpp85 -79.97 100.28 8.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.411 ' HZ1' ' CD ' ' B' ' 61' ' ' GLU . 78.3 mttt -82.59 112.75 19.76 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.751 -178.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -139.25 161.67 36.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.638 0.733 . . . . 10.0 111.975 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 35.3 tp -130.37 108.07 9.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.569 -1.196 . . . . 10.0 108.521 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -135.62 157.38 47.01 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.832 0.349 . . . . 10.0 110.508 -178.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 29' ' ' ARG . 8.6 ttp180 -97.51 114.66 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 23.9 m -124.69 162.16 27.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.769 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 2.4 p -95.31 122.23 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.925 0.393 . . . . 10.0 110.635 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.435 ' CD1' ' H71' ' C' ' 5' ' ' ' DT' . 8.1 m0 -63.86 109.46 1.76 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.768 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 60.11 29.55 19.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.931 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 t0 61.63 35.11 17.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.803 -1.09 . . . . 10.0 110.715 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.64 -76.8 0.58 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.01 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -92.48 116.16 66.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.45 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 61.3 Cg_endo -81.63 120.6 3.56 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.514 2.143 . . . . 10.0 111.049 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -149.88 159.55 44.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.686 0.279 . . . . 10.0 110.48 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -78.68 133.95 37.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.895 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -144.43 129.01 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 12.8 tt -106.13 122.44 59.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.289 0.566 . . . . 10.0 110.486 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.568 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.8 mtp85 -149.14 174.27 12.52 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.252 -178.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.564 ' OG1' ' H71' ' C' ' 2' ' ' ' DT' . 1.8 p -124.19 138.44 54.41 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.625 -0.879 . . . . 10.0 108.625 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -117.89 176.92 4.98 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 121.081 -0.248 . . . . 10.0 110.987 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -66.13 150.7 96.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.365 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.04 -38.16 96.59 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.91 2.407 . . . . 10.0 112.65 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -88.11 5.7 39.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.893 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 57.86 28.05 15.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.277 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -81.03 -31.91 34.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.451 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -140.71 174.79 10.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 10.0 111.587 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.79 172.59 10.69 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.012 -0.994 . . . . 10.0 110.929 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.704 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -138.35 -170.26 11.81 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.734 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.424 ' HA ' ' NH2' ' A' ' 42' ' ' ARG . 22.4 mttp -103.62 141.77 35.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 10.0 112.301 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.426 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -141.0 -117.46 1.37 Allowed Glycine 0 N--CA 1.453 -0.192 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -152.78 142.12 14.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 117.381 0.591 . . . . 10.0 110.976 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 m -96.77 135.13 39.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.333 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 65.3 mt -115.02 117.44 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -78.58 169.96 17.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.567 -0.288 . . . . 10.0 110.558 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -57.38 -44.86 84.78 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.164 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.43 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 7.4 pt-20 -54.97 -45.04 74.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.854 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.43 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 34.8 mt-10 -69.26 -59.77 2.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.008 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.562 ' CE2' HD12 ' A' ' 66' ' ' LEU . 3.5 t80 -52.32 -42.15 63.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.73 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.68 -59.68 10.33 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.233 -0.508 . . . . 10.0 112.648 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 72.3 t -64.63 -41.28 91.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.99 0.424 . . . . 10.0 110.604 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.1 tp -57.67 -54.24 49.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.807 -179.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.562 HD12 ' CE2' ' A' ' 62' ' ' PHE . 17.2 mt -62.37 -43.24 99.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.702 -0.226 . . . . 10.0 111.464 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -53.43 -50.77 64.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.196 0.522 . . . . 10.0 110.733 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.616 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 41.8 mm-40 -71.5 -48.82 46.53 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.384 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.8 mt -57.37 -45.45 84.43 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.742 0.275 . . . . 10.0 111.742 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.69 -38.06 95.28 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 111.322 -0.711 . . . . 10.0 111.322 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -73.51 -25.21 60.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.869 0.366 . . . . 10.0 110.758 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.616 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.82 -29.02 68.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.883 0.373 . . . . 10.0 110.685 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 36.9 mt -87.72 3.14 49.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.146 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 C--O 1.252 1.184 0 CA-C-O 118.607 -0.711 . . . . 10.0 109.998 179.495 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mmm . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.916 0.389 . . . . 10.0 110.58 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.44 161.22 16.38 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.487 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.514 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 26.7 t70 -64.13 -50.26 68.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.183 0.516 . . . . 10.0 109.754 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.514 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 40.7 mmtm -135.02 109.88 8.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.672 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.505 HD21 ' H72' ' C' ' 14' ' ' ' DT' . 35.7 tp -83.88 135.82 34.35 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.992 -0.373 . . . . 10.0 109.992 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.411 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.2 tppt? -71.34 137.37 48.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.161 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.661 ' CD1' ' H71' ' C' ' 14' ' ' ' DT' . 11.8 p90 -164.59 177.25 8.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.256 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -159.88 131.97 6.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . 0.402 ' HA ' HG12 ' B' ' 30' ' ' VAL . 51.4 mt -78.37 108.87 12.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 10.0 110.697 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.3 mm -80.02 -50.23 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.139 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -156.51 130.75 8.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.949 -0.568 . . . . 10.0 111.237 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.08 132.14 35.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 57.4 mt -103.87 -71.42 0.73 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.648 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.434 HD11 ' CB ' ' A' ' 68' ' ' GLU . 19.8 mm -131.8 142.37 43.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.978 0.418 . . . . 10.0 111.946 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.8 p -124.26 121.51 61.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.277 -1.009 . . . . 10.0 108.277 177.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 37.0 mt -88.24 -80.54 0.27 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.615 -0.434 . . . . 10.0 111.489 -178.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 175.25 -178.01 0.11 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.491 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 35.3 mp0 -97.15 163.76 12.79 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.77 -164.01 0.89 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.921 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.33 -23.57 64.72 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.294 0.568 . . . . 10.0 110.3 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -93.8 -0.35 55.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.937 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.39 0.03 89.36 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.829 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.491 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.5 m0 -53.59 107.62 0.27 Allowed 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.554 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.1 tpp85 -80.46 100.2 8.39 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -81.5 113.19 19.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.857 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -139.74 162.03 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.519 0.676 . . . . 10.0 112.037 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 32.8 tp -131.76 107.14 8.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.725 -1.125 . . . . 10.0 108.517 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -135.5 155.95 49.68 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.634 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -96.18 114.53 26.24 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.402 HG12 ' HA ' ' B' ' 9' ' ' ILE . 17.0 m -122.91 162.19 23.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.443 -179.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.0 p -94.97 121.96 37.13 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.949 0.404 . . . . 10.0 110.373 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.722 ' CH2' ' H72' ' C' ' 17' ' ' ' DT' . 6.7 m0 -63.63 109.92 1.84 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.661 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.411 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.9 m-80 60.54 28.14 17.81 Favored 'General case' 0 N--CA 1.462 0.14 0 O-C-N 123.781 0.676 . . . . 10.0 110.115 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.0 t70 65.91 25.29 11.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.585 -1.189 . . . . 10.0 110.982 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.74 -78.41 0.58 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.13 -0.356 . . . . 10.0 111.916 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -87.48 117.17 68.2 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.775 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.412 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 58.9 Cg_endo -82.82 119.45 2.91 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.143 1.896 . . . . 10.0 110.971 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 12.3 ttpt -148.51 158.38 44.08 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 121.01 -0.276 . . . . 10.0 110.471 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -78.6 133.08 37.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.457 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -143.72 129.25 19.09 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . 0.414 ' HB ' HD13 ' B' ' 27' ' ' LEU . 12.1 tt -106.67 122.5 60.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.287 0.565 . . . . 10.0 110.525 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.583 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.2 mtp85 -149.23 175.07 11.71 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.332 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.554 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.4 p -125.17 138.3 54.14 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.8 m-90 -117.88 176.87 5.0 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.921 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.8 m -64.99 150.79 94.76 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.581 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.39 -42.27 69.93 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.788 2.325 . . . . 10.0 112.408 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -88.36 11.75 15.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.117 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 53.48 33.35 15.89 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.563 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -84.02 -32.79 24.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.371 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -141.32 174.31 10.66 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.325 0.584 . . . . 10.0 111.351 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.27 173.05 9.58 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.711 -1.131 . . . . 10.0 110.646 -178.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.67 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -139.72 -169.21 11.56 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.979 -0.629 . . . . 10.0 112.578 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . 0.426 ' HA ' ' NH2' ' B' ' 42' ' ' ARG . 18.3 mttp -102.26 144.59 30.58 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.237 0.541 . . . . 10.0 112.033 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -144.18 -120.25 1.41 Allowed Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 110.73 -0.948 . . . . 10.0 110.73 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -151.65 142.38 15.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 117.309 0.555 . . . . 10.0 110.603 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 2.5 m -96.55 136.09 37.54 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.648 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.83 117.53 30.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.324 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.65 171.18 15.51 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.664 -0.243 . . . . 10.0 110.534 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -58.39 -44.83 89.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.98 0.419 . . . . 10.0 110.323 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.423 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.4 pt-20 -55.13 -45.03 75.58 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.894 178.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.423 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 33.5 mt-10 -70.25 -60.52 2.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.936 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -52.83 -38.27 61.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.658 -0.701 . . . . 10.0 111.553 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.96 -57.9 16.41 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.157 -0.544 . . . . 10.0 112.616 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 43.4 t -66.76 -40.07 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.442 . . . . 10.0 110.423 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.0 tp -58.21 -53.18 61.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.604 -0.725 . . . . 10.0 111.03 -179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 55.9 mt -60.3 -49.89 75.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.273 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.7 tttm -50.78 -51.58 49.16 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.464 0.477 . . . . 10.0 111.657 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.591 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 21.9 mm-40 -70.41 -49.2 51.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.71 -179.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.429 ' HB3' HD21 ' A' ' 66' ' ' LEU . 60.8 mt -59.81 -42.74 94.15 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.49 -39.4 97.78 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -72.88 -25.44 61.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.065 0.459 . . . . 10.0 111.037 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.591 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.6 mmtt -66.44 -29.67 69.86 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.997 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.483 ' CD1' ' HB3' ' A' ' 66' ' ' LEU . 26.1 mt -90.97 5.15 49.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.999 -0.28 . . . . 10.0 111.395 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 . . . . . 0 C--O 1.25 1.102 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 178.117 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.489 ' H71' ' O ' ' A' ' 20' ' ' ALA . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 C3'-C2'-C1' 101.701 -0.714 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.564 ' H71' ' OG1' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C3'-C2'-C1' 101.457 -0.888 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.861 0 O4'-C1'-C2' 104.074 -1.842 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.704 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C4'-C3'-C2' 101.331 -1.869 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.568 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.962 0 O4'-C4'-C3' 103.485 -2.115 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.808 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.434 1.049 0 C5'-C4'-O4' 113.17 2.356 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.889 0 C3'-C2'-C1' 101.18 -1.086 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 C3'-C2'-C1' 101.365 -0.954 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.519 ' H73' ' HG1' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 C5'-C4'-C3' 115.717 0.678 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.424 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 O4'-C1'-C2' 104.257 -1.676 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.67 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 C4'--C3' 1.52 -0.791 0 O4'-C4'-C3' 103.604 -1.996 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.583 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.977 0 O4'-C4'-C3' 103.669 -1.931 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.801 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.953 0 C5'-C4'-O4' 113.237 2.398 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.722 ' H72' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.424 -0.973 0 C3'-C2'-C1' 101.049 -1.179 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.971 0.415 . . . . 10.0 110.653 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -111.11 173.22 6.44 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.56 -54.95 8.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -137.41 104.18 5.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.846 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.559 HD23 ' H72' ' C' ' 4' ' ' ' DT' . 23.8 tp -73.46 145.97 45.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.164 179.025 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -76.12 131.53 39.47 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.055 0.455 . . . . 10.0 110.583 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.1 p90 -156.16 166.52 33.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.808 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.506 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.5 tp10 -150.95 124.35 8.92 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.505 -0.554 . . . . 10.0 109.505 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.2 mt -75.67 110.23 10.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.031 0.443 . . . . 10.0 110.106 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.5 mm -80.92 -43.34 20.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.43 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -164.22 128.13 2.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.972 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -76.45 135.22 39.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.584 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 95.9 mt -105.93 -74.84 0.64 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.78 -0.368 . . . . 10.0 111.809 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.424 HD11 ' HB3' ' B' ' 68' ' ' GLU . 23.8 mm -132.71 138.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.338 0.59 . . . . 10.0 112.318 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.01 119.8 59.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 107.693 -1.225 . . . . 10.0 107.693 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.439 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.7 mt -88.85 -80.85 0.28 Allowed 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.382 -0.527 . . . . 10.0 111.816 -178.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -175.67 -171.94 0.5 Allowed 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.443 -0.577 . . . . 10.0 109.443 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.7 mp0 -105.47 140.92 37.84 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -79.21 -170.78 2.4 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.401 ' O ' ' H73' ' C' ' 1' ' ' ' DT' . . . -64.42 -26.03 68.27 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.566 0.698 . . . . 10.0 110.618 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.415 ' HG2' ' C2 ' ' C' ' 1' ' ' ' DT' . 22.9 mttt -91.28 4.55 52.06 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.028 -0.987 . . . . 10.0 110.921 -179.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.22 7.27 87.95 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.454 -0.879 . . . . 10.0 110.98 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -62.14 101.4 0.22 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 10.0 111.416 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.7 tpp85 -81.48 103.25 11.09 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.932 -0.577 . . . . 10.0 109.671 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -86.5 113.29 22.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.798 0.333 . . . . 10.0 110.153 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -129.93 146.94 51.64 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.353 0.597 . . . . 10.0 111.464 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.584 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 26.3 tp -114.05 108.0 16.42 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.716 -1.216 . . . . 10.0 107.716 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -134.44 152.95 52.11 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.944 0.402 . . . . 10.0 111.27 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -86.67 114.65 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.77 158.3 41.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.941 0.401 . . . . 10.0 110.828 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.506 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.9 p -97.13 125.05 41.36 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.629 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.6 m0 -64.49 108.04 1.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.652 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.441 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.3 m-80 60.03 29.06 18.66 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 123.776 0.672 . . . . 10.0 110.488 -178.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.4 t70 66.75 18.0 10.64 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.928 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.6 -79.15 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.988 -0.445 . . . . 10.0 111.918 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -97.19 124.92 47.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -178.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.474 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.3 Cg_endo -83.85 121.81 2.91 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 123.017 2.478 . . . . 10.0 111.874 178.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.44 ' HD2' ' CG2' ' A' ' 56' ' ' THR . 13.8 ttmm -143.98 167.24 22.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -88.42 133.54 34.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.503 0.192 . . . . 10.0 110.746 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.492 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -146.89 130.09 16.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.486 ' HB ' HD12 ' A' ' 27' ' ' LEU . 10.6 tt -104.56 122.9 58.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.503 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.2 mtt85 -142.04 -178.38 5.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -177.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -113.44 142.17 46.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.962 -1.017 . . . . 10.0 112.02 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -123.7 164.3 19.39 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.48 -0.782 . . . . 10.0 109.007 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.2 p -78.37 158.89 76.01 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.27 -20.91 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.431 2.087 . . . . 10.0 112.283 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.28 0.53 25.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.177 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 56.26 37.01 28.43 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.647 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -90.62 -39.73 12.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.274 0.559 . . . . 10.0 109.975 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -134.04 174.64 10.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.344 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.424 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -147.88 172.94 13.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.963 -177.544 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.689 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -128.6 -162.17 10.91 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.319 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -98.9 152.13 20.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.671 . . . . 10.0 111.694 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -140.98 -122.32 1.85 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.326 -0.71 . . . . 10.0 111.326 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.9 tt -151.65 140.84 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.265 0.555 . . . . 10.0 111.154 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.44 ' CG2' ' HD2' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -99.79 144.3 29.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.17 -179.894 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.84 128.62 47.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.17 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.19 163.9 26.13 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.924 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -55.6 -48.51 74.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.854 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.32 -47.64 83.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 10.0 111.076 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -61.04 -45.39 94.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.686 ' CE2' HD13 ' A' ' 66' ' ' LEU . 26.9 t80 -60.94 -45.19 95.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.268 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.33 -52.22 53.98 Favored Glycine 0 N--CA 1.451 -0.3 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.722 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.4 t -62.25 -42.27 94.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.877 0.37 . . . . 10.0 110.478 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -58.12 -54.4 47.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.794 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.686 HD13 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -63.39 -43.09 98.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.15 -0.22 . . . . 10.0 111.578 -179.137 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.0 tttm -52.78 -51.33 61.13 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 26.0 mm-40 -71.03 -45.32 64.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.599 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.5 mt -59.19 -43.66 92.19 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.664 0.269 . . . . 10.0 111.099 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.68 -38.31 96.22 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.574 -0.822 . . . . 10.0 111.084 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -69.68 -28.76 66.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.996 0.426 . . . . 10.0 110.491 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.9 mmtt -68.71 -30.23 68.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.07 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 41.8 mt -86.17 -11.44 52.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.192 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.562 -0.732 . . . . 10.0 110.835 -179.821 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.751 0.31 . . . . 10.0 110.518 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.52 175.68 5.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.4 -55.08 6.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.046 0.451 . . . . 10.0 109.865 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' B' ' 4' ' ' LYS . 13.3 mmmm -136.54 103.65 5.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.543 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.539 HD23 ' H71' ' C' ' 14' ' ' ' DT' . 25.3 tp -73.12 144.27 47.03 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.098 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.9 tppt? -75.8 128.56 35.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.331 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.9 p90 -153.52 165.84 34.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.119 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.501 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.6 tp10 -150.51 124.49 9.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.58 110.22 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.199 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -80.77 -41.49 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.335 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -164.71 129.23 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.927 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.68 137.89 39.67 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.419 -0.956 . . . . 10.0 108.419 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.564 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 95.1 mt -108.96 -73.15 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.022 -0.671 . . . . 10.0 111.997 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.418 HD13 ' CB ' ' A' ' 68' ' ' GLU . 15.3 mm -131.22 139.45 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.984 0.421 . . . . 10.0 111.848 -177.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.7 117.2 49.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 177.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -85.7 -80.8 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.798 -0.361 . . . . 10.0 111.677 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.1 m -179.21 -171.61 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 50.3 mp0 -103.08 142.77 33.55 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.131 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -81.21 -171.07 3.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.96 -0.563 . . . . 10.0 109.531 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -18.81 65.56 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.368 0.604 . . . . 10.0 110.918 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 17.7 mttt -97.84 3.99 49.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.308 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.94 6.28 86.93 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.509 -0.853 . . . . 10.0 111.293 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.481 ' CE2' ' H72' ' C' ' 12' ' ' ' DT' . 42.4 m0 -62.04 102.53 0.29 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.911 0.386 . . . . 10.0 111.372 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 16.4 tpp85 -81.72 102.27 10.63 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.831 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.72 113.75 22.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.711 0.291 . . . . 10.0 110.299 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -130.87 147.67 52.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.241 0.543 . . . . 10.0 111.193 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.564 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 28.8 tp -115.22 107.87 15.86 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.908 -1.145 . . . . 10.0 107.908 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -133.72 154.11 51.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.867 0.365 . . . . 10.0 111.047 -177.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -88.05 114.19 24.42 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.361 -0.977 . . . . 10.0 108.361 178.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 16.2 m -127.37 158.1 38.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.791 0.329 . . . . 10.0 110.703 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.501 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.2 p -96.81 124.83 40.9 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.941 0.401 . . . . 10.0 110.565 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -63.97 108.68 1.56 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.574 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.486 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 61.9 m-80 58.66 30.69 20.24 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.369 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 36.0 t70 67.31 14.91 9.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.81 -1.087 . . . . 10.0 111.557 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.35 -81.35 0.47 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.053 0.39 . . . . 10.0 112.053 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -94.45 124.83 54.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 71.0 Cg_endo -83.14 124.13 3.7 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.743 2.296 . . . . 10.0 112.032 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.92 164.46 31.94 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -87.07 130.77 34.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.337 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.462 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.2 t0 -144.58 131.17 19.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . 0.52 ' HB ' HD12 ' B' ' 27' ' ' LEU . 10.8 tt -105.22 123.0 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.566 HH21 H2'' ' C' ' 14' ' ' ' DT' . 2.9 mtp85 -142.33 -178.08 5.57 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.606 0.595 . . . . 10.0 112.606 -177.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.539 ' OG1' ' H71' ' C' ' 12' ' ' ' DT' . 1.2 p -114.28 143.11 45.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.976 -1.011 . . . . 10.0 112.149 -178.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 54.7 m95 -123.56 166.19 15.86 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.488 -0.778 . . . . 10.0 108.906 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -80.02 159.31 71.11 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.2 -26.1 67.96 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.578 2.186 . . . . 10.0 112.471 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -104.03 0.36 29.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.582 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER 58.84 37.29 24.89 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.577 -0.738 . . . . 10.0 111.766 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -89.87 -38.94 13.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.148 0.499 . . . . 10.0 110.384 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -134.86 174.35 10.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.321 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.43 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -147.01 173.07 12.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.929 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.693 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -128.98 -162.55 10.98 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.142 -0.552 . . . . 10.0 112.277 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -96.95 154.2 17.44 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.013 -0.698 . . . . 10.0 111.708 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.44 -122.62 1.77 Allowed Glycine 0 C--N 1.331 0.264 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.384 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.2 tt -152.53 139.84 13.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 117.276 0.538 . . . . 10.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.23 141.96 31.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.1 mt -124.61 126.24 45.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.157 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -73.81 164.56 26.48 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.385 -0.371 . . . . 10.0 110.149 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -58.4 -44.48 89.0 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.474 ' O ' HG21 ' B' ' 64' ' ' VAL . 8.2 pt-20 -65.54 -43.92 88.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 10.0 110.793 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -64.82 -47.64 77.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.385 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.613 ' CE2' HD12 ' B' ' 66' ' ' LEU . 12.5 t80 -59.44 -40.22 86.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.799 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.72 -53.33 46.22 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.595 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.474 HG21 ' O ' ' B' ' 60' ' ' GLU . 20.1 t -62.05 -42.15 93.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 120.924 0.392 . . . . 10.0 110.261 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.9 tp -58.28 -54.19 49.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.937 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.613 HD12 ' CE2' ' B' ' 62' ' ' PHE . 45.9 mt -61.17 -48.72 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.08 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -50.15 -53.86 24.71 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.75 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 24.3 mm-40 -69.22 -45.69 69.22 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.872 -178.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.454 HD11 ' CD2' ' A' ' 66' ' ' LEU . 70.8 mt -61.09 -42.34 98.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.612 0.244 . . . . 10.0 111.279 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.98 -38.13 96.09 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.673 -0.971 . . . . 10.0 110.673 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -70.09 -30.54 67.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.294 -0.453 . . . . 10.0 110.508 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.9 mmtt -65.65 -31.31 72.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.559 -0.291 . . . . 10.0 111.35 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 29.4 mt -90.36 -3.07 57.96 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.45 -0.786 . . . . 10.0 109.926 179.664 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.415 ' C2 ' ' HG2' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 O5'-C5'-C4' 109.017 -0.845 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 101.335 -0.975 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -0.968 0 O4'-C1'-C2' 104.081 -1.835 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.689 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C4'-C3' 103.549 -2.051 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 O4'-C4'-C3' 103.41 -2.19 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.864 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.928 0 C5'-C4'-O4' 113.1 2.313 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.938 0 C3'-C2'-C1' 101.12 -1.128 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 101.038 -1.187 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.539 ' H71' ' OG1' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.425 -0.944 0 C5'-C4'-C3' 115.756 0.704 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.942 0 O4'-C1'-C2' 104.458 -1.493 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.693 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 O4'-C4'-C3' 103.483 -2.117 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 O4'-C4'-C3' 103.903 -1.697 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.834 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.825 0 C5'-C4'-O4' 113.213 2.383 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 101.051 -1.178 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 mmt . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.819 0.343 . . . . 10.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -93.01 169.46 10.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.698 -0.482 . . . . 10.0 109.698 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.99 -47.4 71.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.081 0.467 . . . . 10.0 110.005 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -137.51 113.92 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.148 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.518 HD23 ' H72' ' C' ' 4' ' ' ' DT' . 24.5 tp -85.1 143.15 29.03 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -78.35 131.67 37.09 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.021 0.439 . . . . 10.0 110.376 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.9 p90 -152.14 171.57 17.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.798 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.533 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.2 tp10 -152.23 121.66 6.82 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.799 -0.445 . . . . 10.0 109.799 179.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 53.2 mt -79.37 105.7 9.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.904 0.383 . . . . 10.0 110.578 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.36 -51.96 19.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.184 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -162.72 130.54 3.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.141 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.92 144.17 41.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.664 -0.495 . . . . 10.0 109.664 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 71.9 mt -109.28 -75.17 0.63 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.783 -0.367 . . . . 10.0 111.915 -178.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.1 mm -128.7 141.69 45.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -177.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -125.13 123.33 65.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 178.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.2 mt -92.24 -79.85 0.38 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.544 -0.462 . . . . 10.0 111.276 -178.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.09 -167.33 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.502 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.7 mp0 -108.53 145.38 34.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.769 0.318 . . . . 10.0 110.516 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -82.28 -173.46 4.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.31 -22.34 66.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.397 0.618 . . . . 10.0 110.509 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -88.62 -1.64 58.17 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.279 -0.873 . . . . 10.0 110.84 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 3.47 81.93 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.611 -0.804 . . . . 10.0 111.294 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.502 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.32 105.5 0.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.693 0.282 . . . . 10.0 111.355 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.4 tpp85 -85.47 100.31 11.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.409 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 93.2 mttt -82.45 115.84 21.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.617 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -134.68 147.31 50.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.792 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.44 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 35.9 tp -116.88 111.76 20.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.43 -0.805 . . . . 10.0 108.956 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -131.54 163.69 27.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 10.0 111.556 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -98.57 113.75 25.91 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.1 m -131.21 159.2 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.007 0.432 . . . . 10.0 111.269 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -96.65 125.14 40.91 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.145 178.821 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.1 m0 -63.81 108.99 1.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.525 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.451 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 58.21 31.93 21.4 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.481 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.8 t70 66.68 23.4 10.24 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 114.981 -1.009 . . . . 10.0 111.2 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.62 -88.27 0.46 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.102 -0.374 . . . . 10.0 111.745 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -95.57 124.88 51.51 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.536 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 59.6 Cg_endo -77.57 128.46 9.5 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.814 2.342 . . . . 10.0 111.851 178.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -147.94 170.06 18.52 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -94.98 131.21 41.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.213 -0.291 . . . . 10.0 110.213 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -142.42 132.01 23.91 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.5 tt -108.09 123.46 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.272 0.558 . . . . 10.0 110.059 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.497 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.4 mtt85 -145.79 177.41 8.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.133 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -124.64 142.55 51.3 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.446 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 28.7 m95 -117.56 171.14 8.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -65.55 156.92 80.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.23 -31.15 75.03 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.607 2.204 . . . . 10.0 112.618 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -97.28 2.79 51.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.178 0.513 . . . . 10.0 110.578 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 59.06 26.81 15.58 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.926 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -78.1 -37.07 47.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.116 0.484 . . . . 10.0 110.824 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -133.57 175.01 9.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.923 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.453 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -138.78 172.55 12.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.366 -0.834 . . . . 10.0 111.104 -177.088 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.752 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.85 -163.05 9.36 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.177 -0.535 . . . . 10.0 112.116 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -94.89 155.38 16.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.949 -0.736 . . . . 10.0 112.322 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.418 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.3 -127.05 1.43 Allowed Glycine 0 CA--C 1.518 0.245 0 N-CA-C 110.686 -0.966 . . . . 10.0 110.686 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -148.89 142.63 18.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 117.606 0.703 . . . . 10.0 111.198 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.409 ' HB ' ' H73' ' C' ' 7' ' ' ' DT' . 0.8 OUTLIER -101.47 141.15 34.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.839 179.878 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -122.09 129.4 52.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.962 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.1 m -74.23 164.97 25.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.013 -0.366 . . . . 10.0 110.013 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.47 -46.68 89.04 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.646 0.239 . . . . 10.0 111.646 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -61.96 -40.8 96.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 10.0 110.488 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.467 ' HB3' HD11 ' B' ' 16' ' ' LEU . 87.5 mt-10 -64.33 -49.79 70.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.357 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.654 ' CE2' HD12 ' A' ' 66' ' ' LEU . 15.1 t80 -57.86 -44.84 86.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.276 -0.874 . . . . 10.0 111.314 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.91 -52.16 53.88 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.284 -0.484 . . . . 10.0 112.477 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.411 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 93.0 t -63.34 -45.06 99.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 110.332 -0.247 . . . . 10.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 24.1 tp -56.19 -52.15 65.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.654 HD12 ' CE2' ' A' ' 62' ' ' PHE . 20.9 mt -62.54 -44.91 95.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.417 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.1 tttm -53.1 -52.02 59.97 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 123.567 0.542 . . . . 10.0 110.818 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.682 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 44.8 mm-40 -66.54 -51.99 50.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.428 -0.806 . . . . 10.0 111.212 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 74.2 mt -56.12 -48.32 76.43 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.184 0.439 . . . . 10.0 112.184 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.28 -39.05 96.66 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.344 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -71.23 -20.72 62.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.032 0.444 . . . . 10.0 111.117 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.682 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.7 mmtt -77.41 -26.68 51.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.601 -0.272 . . . . 10.0 110.796 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 24.5 mt -82.96 -19.2 37.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.996 -0.281 . . . . 10.0 111.297 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.385 -0.817 . . . . 10.0 110.887 -179.605 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.2 mmt . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.712 0.291 . . . . 10.0 110.336 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.53 168.52 11.2 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.422 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 28.9 t70 -68.85 -46.7 67.82 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 39.5 mmtm -137.19 107.7 6.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.176 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.628 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 31.1 tp -79.89 141.07 36.45 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.45 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.7 tppt? -77.35 130.17 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.249 0.547 . . . . 10.0 110.738 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -150.94 173.36 14.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.699 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.541 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.4 tp10 -154.72 122.79 5.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 52.9 mt -78.77 108.88 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.133 0.492 . . . . 10.0 110.784 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -78.87 -47.64 22.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.039 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -167.59 130.55 1.66 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.112 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -75.22 145.77 41.72 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 81.2 mt -112.0 -74.66 0.63 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.477 -0.489 . . . . 10.0 111.902 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 16.0 mm -127.24 140.8 48.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.025 0.44 . . . . 10.0 111.903 -177.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.93 122.48 62.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.078 -1.082 . . . . 10.0 108.078 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . 0.467 HD11 ' HB3' ' A' ' 61' ' ' GLU . 28.8 mt -92.06 -81.29 0.34 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.373 -0.531 . . . . 10.0 111.778 -178.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -179.18 -167.71 0.11 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.15 147.55 31.12 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.348 -0.242 . . . . 10.0 110.348 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -85.15 -172.15 4.02 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.34 -20.82 66.19 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.472 0.654 . . . . 10.0 110.464 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -90.21 -2.55 58.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.177 -0.92 . . . . 10.0 110.323 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 4.52 80.85 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.478 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.7 m0 -62.33 105.99 0.69 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.748 0.308 . . . . 10.0 111.333 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.473 ' O ' ' HA ' ' B' ' 43' ' ' THR . 12.3 tpp85 -85.21 100.31 11.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.593 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.415 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 93.9 mttt -82.06 115.73 21.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.735 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -134.23 146.61 50.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.859 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.489 HD12 ' HB ' ' B' ' 41' ' ' ILE . 42.7 tp -115.92 111.86 21.03 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.668 -0.864 . . . . 10.0 108.668 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -132.34 162.29 31.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.126 0.488 . . . . 10.0 111.623 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.1 ttm180 -97.7 113.91 25.77 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 22.8 m -131.55 157.12 43.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.904 0.383 . . . . 10.0 111.297 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.541 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -94.19 125.3 38.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.194 178.785 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.596 ' CH2' ' H72' ' C' ' 17' ' ' ' DT' . 5.2 m0 -63.88 109.2 1.68 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.543 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.45 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.5 m-80 58.5 32.91 22.65 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.831 0.707 . . . . 10.0 110.368 -178.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 67.63 17.79 9.9 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.946 -1.025 . . . . 10.0 111.414 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.04 -89.77 0.38 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.13 0.419 . . . . 10.0 112.13 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -90.96 123.32 65.06 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 112.271 0.471 . . . . 10.0 112.271 -177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.529 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.87 126.75 8.98 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.831 2.354 . . . . 10.0 111.701 178.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.402 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 18.6 ttmm -147.07 170.78 16.43 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . 0.402 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 6.3 m-85 -96.94 129.22 44.43 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.325 -0.25 . . . . 10.0 110.325 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.417 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.56 132.25 28.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.279 -0.638 . . . . 10.0 109.279 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . 0.489 ' HB ' HD12 ' B' ' 27' ' ' LEU . 13.2 tt -106.82 122.7 61.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.324 0.583 . . . . 10.0 110.16 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.596 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.0 mtt85 -145.6 176.8 9.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.002 -0.544 . . . . 10.0 111.257 -178.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.5 ' HG1' ' H73' ' C' ' 12' ' ' ' DT' . 0.1 OUTLIER -123.85 142.92 50.68 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.332 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 m95 -117.15 173.37 6.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.103 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.0 m -67.87 157.79 85.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -55.44 -31.44 77.87 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.504 2.136 . . . . 10.0 112.48 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -99.3 6.08 46.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.464 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.48 28.39 15.42 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.102 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.58 -38.45 40.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.725 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -133.41 174.23 10.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.112 0.482 . . . . 10.0 111.128 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.4 172.22 13.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.165 -0.925 . . . . 10.0 111.199 -177.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.721 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.88 -161.25 8.67 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.984 -0.627 . . . . 10.0 111.797 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -97.79 153.16 18.47 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 122.17 -0.606 . . . . 10.0 112.485 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.61 -124.26 1.46 Allowed Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.403 -1.079 . . . . 10.0 110.403 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -153.16 143.25 14.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 117.549 0.675 . . . . 10.0 111.219 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.5 143.78 31.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.383 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 63.7 mt -123.19 129.08 50.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.08 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.0 m -74.59 163.09 28.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.79 -44.86 93.74 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 -178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.503 ' O ' HG22 ' B' ' 64' ' ' VAL . 10.1 pt-20 -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.133 0.492 . . . . 10.0 110.465 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.143 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.522 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -58.01 -41.36 82.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.544 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.53 -52.84 50.52 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.06 -0.59 . . . . 10.0 112.059 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.503 HG22 ' O ' ' B' ' 60' ' ' GLU . 28.0 t -63.96 -45.0 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 10.0 110.139 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.8 tp -55.72 -51.43 67.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.012 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 65.4 mt -61.19 -48.92 79.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.976 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 46.6 tttm -52.58 -52.54 54.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.549 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.624 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 51.2 mm-40 -65.94 -53.18 42.47 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.558 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.462 ' HB3' HD23 ' A' ' 66' ' ' LEU . 61.3 mt -57.96 -44.06 86.8 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.158 0.429 . . . . 10.0 112.158 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.2 -41.04 99.36 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 111.191 -0.764 . . . . 10.0 111.191 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -72.24 -22.5 61.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.314 -0.443 . . . . 10.0 111.565 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.6 mmtt -72.41 -26.55 61.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 22.5 mt -88.3 -5.88 58.08 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.151 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.453 -0.784 . . . . 10.0 109.884 179.716 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.434 -0.387 0 C3'-C2'-C1' 101.814 -0.633 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.469 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 C3'-C2'-C1' 101.519 -0.843 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.469 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -1.007 0 O4'-C1'-C2' 104.05 -1.864 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.752 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 O4'-C4'-C3' 103.464 -2.136 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.416 ' C6 ' HD22 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 O4'-C4'-C3' 103.523 -2.077 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.802 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.885 0 C5'-C4'-O4' 113.078 2.299 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.409 ' H73' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 101.141 -1.113 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 C3'-C2'-C1' 101.64 -0.757 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.5 ' H73' ' HG1' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 101.892 -0.577 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.414 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 O4'-C1'-C2' 104.393 -1.551 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.721 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C4'-C3' 103.455 -2.145 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 O4'-C4'-C3' 103.737 -1.863 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.817 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.434 1.046 0 C5'-C4'-O4' 112.916 2.198 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.596 ' H72' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.424 -0.988 0 C3'-C2'-C1' 101.06 -1.171 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.223 0 CA-C-O 120.69 0.281 . . . . 10.0 110.619 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.12 164.32 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.148 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.6 -48.05 42.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.225 0.536 . . . . 10.0 109.762 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -139.48 95.19 2.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.305 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.695 HD13 H5'' ' C' ' 5' ' ' ' DT' . 22.4 tp -68.93 146.33 52.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.439 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 35.3 tptt -79.37 134.83 36.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.652 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -161.87 166.73 25.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.222 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.482 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -151.8 133.07 14.49 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.635 -0.505 . . . . 10.0 109.635 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.4 mt -79.85 111.24 16.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.601 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -82.12 -45.81 19.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.056 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -164.73 127.5 2.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.839 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -80.05 142.07 35.27 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 48.5 mt -112.12 -73.74 0.66 Allowed 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.409 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.449 HD13 ' O ' ' A' ' 13' ' ' LEU . 29.0 mm -130.23 138.2 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.71 118.3 56.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 107.403 -1.332 . . . . 10.0 107.403 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.434 HD22 ' HB ' ' B' ' 64' ' ' VAL . 28.1 mt -85.81 -82.12 0.2 Allowed 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.138 -0.625 . . . . 10.0 111.808 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.2 m -174.97 -166.34 0.23 Allowed 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.538 -0.541 . . . . 10.0 109.538 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.435 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.4 mp0 -109.78 143.15 40.01 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.89 -0.411 . . . . 10.0 109.89 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -81.69 -171.82 3.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.79 -27.93 69.52 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.492 0.663 . . . . 10.0 110.391 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -87.55 3.2 48.43 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.031 -0.986 . . . . 10.0 111.0 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.11 6.27 88.32 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.545 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.435 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -61.9 103.71 0.38 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 10.0 111.416 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.45 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.9 tpp85 -81.26 99.53 8.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.185 178.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.426 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 93.0 mttt -83.96 121.04 26.84 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.957 0.408 . . . . 10.0 110.762 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -136.12 153.34 51.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.944 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 42.6 tp -123.02 106.96 11.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.918 . . . . 10.0 108.646 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -136.58 156.49 48.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.176 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -95.69 114.58 26.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.4 m -121.86 161.97 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.469 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.482 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -94.39 123.86 38.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.01 0.433 . . . . 10.0 110.43 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.97 108.41 1.49 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.619 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.7 m-80 60.81 27.4 17.2 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.003 -178.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.6 t70 68.62 19.57 8.57 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.938 -1.028 . . . . 10.0 110.914 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.92 -80.09 0.57 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.97 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.68 118.76 69.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -178.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.9 Cg_endo -77.95 120.3 5.0 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.621 2.214 . . . . 10.0 110.711 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -145.8 162.97 36.44 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.867 -0.333 . . . . 10.0 110.788 -177.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -86.57 128.32 34.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.558 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.419 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -143.03 131.46 22.24 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 17.9 tt -107.2 123.29 62.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.178 0.513 . . . . 10.0 110.099 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.617 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.1 mtt85 -145.32 177.6 8.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.458 -178.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.45 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -124.96 143.95 50.62 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.726 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 m95 -117.71 173.8 6.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.142 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 p -76.64 156.18 83.07 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.23 -27.62 85.49 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.726 2.284 . . . . 10.0 112.715 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -97.37 -4.58 38.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.651 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.29 34.01 16.17 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.45 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -83.93 -39.36 19.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.762 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -140.56 173.74 11.2 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.21 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.414 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -135.55 172.78 12.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.943 -177.931 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.723 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -137.32 -164.88 10.22 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 121.001 -0.619 . . . . 10.0 112.499 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.5 mttp -95.01 151.92 18.76 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.113 -0.639 . . . . 10.0 112.375 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.78 -128.43 1.89 Allowed Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.277 -0.874 . . . . 10.0 111.479 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -147.34 145.82 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 CA-C-N 117.727 0.764 . . . . 10.0 111.233 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -104.96 144.4 31.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.382 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.8 mt -122.43 135.16 54.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.771 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.427 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 3.4 m -77.46 164.51 25.37 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.127 -0.324 . . . . 10.0 110.127 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -59.39 -48.63 80.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.663 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.25 -43.57 97.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.965 0.412 . . . . 10.0 110.804 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.427 ' CD ' ' HG ' ' A' ' 58' ' ' SER . 91.4 mt-10 -59.14 -48.89 79.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.246 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.495 ' CE2' HD13 ' A' ' 66' ' ' LEU . 33.5 t80 -58.06 -42.15 84.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.006 -0.997 . . . . 10.0 111.167 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.75 34.4 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.277 -0.487 . . . . 10.0 112.489 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 71.5 t -60.38 -43.7 94.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-O 120.969 0.414 . . . . 10.0 110.165 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.45 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -56.48 -52.85 63.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.542 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.495 HD13 ' CE2' ' A' ' 62' ' ' PHE . 17.5 mt -62.12 -45.67 92.43 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -52.37 -52.42 53.64 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.431 0.457 . . . . 10.0 111.19 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 52.1 mm-40 -68.69 -48.39 64.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.433 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.2 mt -58.97 -45.09 91.41 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.672 0.249 . . . . 10.0 111.672 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.76 -37.18 94.32 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.688 -0.767 . . . . 10.0 111.575 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -71.92 -30.06 64.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.82 0.343 . . . . 10.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 44.9 mmtt -64.63 -27.91 69.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.01 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 23.3 mt -88.75 -2.13 58.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 10.0 111.78 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.651 -179.592 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.801 0.334 . . . . 10.0 110.667 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.78 167.22 10.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.598 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -76.39 -47.94 21.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -139.46 99.2 3.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.231 -0.895 . . . . 10.0 110.102 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.547 HD23 ' H71' ' C' ' 14' ' ' ' DT' . 26.5 tp -72.88 142.04 47.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.12 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 10.3 tppt? -77.15 134.39 38.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.948 0.404 . . . . 10.0 110.215 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.453 ' HB3' ' H73' ' C' ' 14' ' ' ' DT' . 7.9 p90 -160.81 165.17 30.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.897 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.449 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.3 tp10 -149.24 131.96 15.95 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 61.2 mt -77.39 112.95 15.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.08 0.467 . . . . 10.0 110.147 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.0 mm -84.45 -42.8 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.096 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -168.35 127.99 1.22 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.644 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -81.41 140.13 34.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 55.7 mt -111.36 -67.19 1.01 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.496 -0.482 . . . . 10.0 112.244 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.465 HD13 ' CB ' ' A' ' 68' ' ' GLU . 12.0 mm -133.97 136.51 53.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 10.0 111.86 -177.14 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 p -120.74 120.04 61.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.233 -1.395 . . . . 10.0 107.233 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -87.04 -81.86 0.22 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.369 -0.532 . . . . 10.0 111.967 -177.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 5.4 m -177.26 -167.75 0.17 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.117 -0.697 . . . . 10.0 109.117 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.407 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 4.3 mp0 -107.07 143.48 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -82.79 -172.63 4.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.06 -25.38 68.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.31 0.576 . . . . 10.0 110.817 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -90.1 2.04 55.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.493 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.1 6.96 84.12 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.493 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.407 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.4 m0 -62.64 103.54 0.43 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.605 0.24 . . . . 10.0 111.613 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -80.35 99.98 8.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.437 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 92.3 mttt -84.23 119.81 25.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 10.0 110.754 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -135.5 151.59 50.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.991 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 39.2 tp -121.62 107.24 12.15 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -136.63 155.5 49.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.283 -178.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -94.81 115.0 26.96 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 m -122.26 161.68 22.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.46 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.449 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.4 p -94.34 123.49 37.78 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.273 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -63.53 109.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.448 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.4 m-80 59.06 30.9 20.82 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 123.734 0.646 . . . . 10.0 109.785 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 63.94 26.27 14.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.924 -1.035 . . . . 10.0 111.159 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.24 -78.17 0.58 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.729 -0.388 . . . . 10.0 111.755 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -88.75 117.02 67.88 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 47.9 Cg_endo -77.93 120.06 4.93 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.292 1.995 . . . . 10.0 110.481 178.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -146.08 164.0 33.51 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.895 -0.322 . . . . 10.0 110.442 -178.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -88.11 128.45 35.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.505 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -142.94 131.91 22.94 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.379 -0.601 . . . . 10.0 109.379 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . 0.402 ' HB ' HD11 ' B' ' 27' ' ' LEU . 8.1 tt -107.03 123.22 62.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 121.514 0.673 . . . . 10.0 110.289 -179.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.615 HH21 H2'' ' C' ' 14' ' ' ' DT' . 4.1 mtt85 -145.54 177.55 8.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.394 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -125.47 144.49 50.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.854 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 42.0 m95 -118.06 174.03 6.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.312 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -77.3 156.65 81.38 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -30.01 87.3 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.652 2.234 . . . . 10.0 112.704 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -98.16 -2.94 38.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.934 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.03 31.38 13.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.545 -179.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -79.63 -39.18 32.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.967 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.19 174.05 10.96 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.36 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.401 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -136.02 172.99 12.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 10.0 110.927 -178.147 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.723 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -136.47 -163.08 9.71 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.113 -0.565 . . . . 10.0 112.273 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -97.4 149.01 22.6 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.033 -0.686 . . . . 10.0 112.33 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.45 -129.11 2.43 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.342 -0.845 . . . . 10.0 111.003 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -147.82 146.68 17.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.343 0.572 . . . . 10.0 110.397 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -104.38 145.36 30.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.58 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.5 mt -123.09 133.72 54.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.691 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' SER . . . . . 0.477 ' HG ' ' CD ' ' B' ' 61' ' ' GLU . 1.9 m -76.58 164.25 26.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.11 -46.92 88.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.829 0.307 . . . . 10.0 111.829 -178.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.459 ' O ' HG21 ' B' ' 64' ' ' VAL . 8.0 pt-20 -65.46 -41.57 93.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.477 ' CD ' ' HG ' ' B' ' 58' ' ' SER . 90.1 mt-10 -61.15 -49.25 77.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.156 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.96 -39.02 80.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.629 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.18 -52.24 53.17 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.934 -0.65 . . . . 10.0 112.287 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.459 HG21 ' O ' ' B' ' 60' ' ' GLU . 12.1 t -63.37 -44.71 99.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 10.0 110.05 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 15.7 tp -54.87 -52.36 63.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.816 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 77.9 mt -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.989 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -49.89 -53.93 22.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.642 -0.708 . . . . 10.0 111.871 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.523 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 13.8 mm-40 -68.84 -47.89 64.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.97 -0.559 . . . . 10.0 112.093 -178.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.468 ' HB3' HD23 ' A' ' 66' ' ' LEU . 69.0 mt -61.65 -43.53 98.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.746 0.308 . . . . 10.0 111.696 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -35.65 92.34 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.517 -0.633 . . . . 10.0 111.517 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . 0.428 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 21.1 t-20 -74.55 -27.63 60.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 10.0 110.872 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.5 mmtt -65.55 -29.04 69.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.837 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 26.0 mt -90.71 6.64 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.965 -0.294 . . . . 10.0 111.655 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.428 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.2 mt-10 . . . . . 0 C--O 1.245 0.829 0 CA-C-O 118.197 -0.906 . . . . 10.0 110.525 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 C3'-C2'-C1' 101.666 -0.738 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.446 ' H71' ' OG1' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 C5'-C4'-C3' 115.887 0.792 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.403 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -0.971 0 O4'-C1'-C2' 104.233 -1.697 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.723 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 O4'--C1' 1.429 0.687 0 O4'-C4'-C3' 103.459 -2.141 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.695 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.887 0 O4'-C4'-C3' 103.461 -2.139 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.818 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.934 0 C5'-C4'-O4' 113.078 2.299 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C3'-C2'-C1' 101.153 -1.105 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 C3'-C2'-C1' 101.386 -0.938 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.909 0 C3'-C2'-C1' 101.629 -0.765 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 O4'-C1'-C2' 104.37 -1.573 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.723 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C4'-C3' 103.574 -2.026 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.422 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 O4'-C4'-C3' 103.771 -1.829 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.812 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.819 0 C5'-C4'-O4' 113.144 2.34 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.862 0 C3'-C2'-C1' 101.258 -1.03 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.15 155.44 17.74 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.58 -55.29 24.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 10.0 109.815 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -132.35 93.89 3.34 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.335 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.525 ' HB3' ' C7 ' ' C' ' 4' ' ' ' DT' . 20.2 tp -65.81 150.79 48.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.355 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 15.4 tppt? -77.63 133.25 38.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.636 0.255 . . . . 10.0 110.455 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -159.14 167.95 27.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.52 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -154.11 129.48 9.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 49.1 mt -79.13 112.58 17.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.142 0.496 . . . . 10.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -79.42 -40.18 21.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.653 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -169.02 141.91 2.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.247 -0.888 . . . . 10.0 110.347 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.89 135.95 33.17 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.615 -0.883 . . . . 10.0 108.615 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 91.2 mt -104.24 -75.29 0.62 Allowed 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.573 -0.451 . . . . 10.0 111.375 -179.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 13' ' ' LEU . 32.6 mm -131.68 139.22 51.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 10.0 112.074 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.9 p -122.63 125.79 73.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 107.622 -1.251 . . . . 10.0 107.622 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.465 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -93.89 -81.05 0.38 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.214 -0.595 . . . . 10.0 111.813 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.5 m -177.76 -169.78 0.23 Allowed 'General case' 0 C--O 1.237 0.4 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 -179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.0 mp0 -104.27 140.62 37.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.374 . . . . 10.0 110.001 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -80.61 -172.0 3.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.61 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.2 -26.47 68.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.716 0.77 . . . . 10.0 110.855 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -91.65 3.93 53.89 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.736 -1.12 . . . . 10.0 111.243 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.23 5.89 89.25 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.518 -0.849 . . . . 10.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -62.95 104.05 0.51 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.928 0.394 . . . . 10.0 110.919 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 43' ' ' THR . 10.5 tpp85 -81.69 99.74 9.08 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.668 -0.696 . . . . 10.0 109.473 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -82.43 117.28 22.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.947 0.403 . . . . 10.0 110.713 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -131.53 148.88 52.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.165 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.525 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 43.2 tp -119.06 107.77 13.91 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 178.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -135.11 163.03 30.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.931 0.396 . . . . 10.0 110.746 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -98.66 114.85 27.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.9 m -125.64 157.87 34.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 10.0 111.01 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.52 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 3.3 p -94.71 123.64 38.27 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.098 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -64.25 110.04 2.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.638 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.43 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.8 m-80 60.53 29.38 18.97 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 123.796 0.685 . . . . 10.0 110.452 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 61.83 34.37 17.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 114.692 -1.14 . . . . 10.0 110.594 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.5 -77.43 0.59 Allowed 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.26 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -88.66 115.24 62.89 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.667 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.419 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.1 Cg_endo -78.26 121.01 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.517 2.145 . . . . 10.0 111.292 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.476 ' NZ ' " H2'" ' C' ' 7' ' ' ' DT' . 17.0 ttpt -149.73 163.38 38.11 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.948 -0.301 . . . . 10.0 110.698 -178.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -85.51 135.29 33.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.439 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -148.84 132.1 16.47 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.9 tt -107.21 122.11 60.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.325 0.583 . . . . 10.0 109.945 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.465 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.4 mtt85 -143.83 179.36 7.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.209 -177.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.563 ' OG1' ' H71' ' C' ' 2' ' ' ' DT' . 0.1 OUTLIER -125.9 145.18 50.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.027 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.5 m95 -117.48 173.85 6.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.214 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.5 p -78.76 159.34 74.14 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -59.47 -27.22 84.41 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.354 2.036 . . . . 10.0 112.422 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -96.11 -0.86 49.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.249 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 55.7 34.89 24.23 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.752 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -92.55 -39.8 11.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.753 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -131.58 174.29 10.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.693 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.424 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -153.4 173.1 16.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.032 -177.674 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.683 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -132.77 -159.56 9.25 Favored Glycine 0 C--O 1.226 -0.38 0 C-N-CA 120.941 -0.647 . . . . 10.0 111.977 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -93.65 161.33 14.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.272 0.536 . . . . 10.0 112.3 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.96 -127.28 1.3 Allowed Glycine 0 CA--C 1.519 0.333 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.974 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -147.88 143.27 19.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 117.838 0.819 . . . . 10.0 111.269 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -100.85 145.92 27.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.231 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.1 mt -125.41 127.1 46.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.849 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.514 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 1.4 m -76.37 163.02 27.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.008 -0.367 . . . . 10.0 110.008 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -55.9 -50.67 70.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.934 0.346 . . . . 10.0 111.934 -178.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -61.61 -46.37 90.13 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.789 0.328 . . . . 10.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.514 ' CD ' ' HG ' ' A' ' 58' ' ' SER . 78.4 mt-10 -60.27 -47.82 84.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.114 0.483 . . . . 10.0 110.476 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.437 ' CE2' HD13 ' A' ' 66' ' ' LEU . 28.2 t80 -59.43 -46.82 87.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.282 -0.872 . . . . 10.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.75 -53.29 46.4 Favored Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 116.178 -0.464 . . . . 10.0 112.578 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.476 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 88.6 t -61.21 -45.55 98.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.674 0.273 . . . . 10.0 110.28 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.534 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 23.2 tp -54.66 -53.05 59.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.669 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.437 HD13 ' CE2' ' A' ' 62' ' ' PHE . 18.4 mt -62.62 -44.45 96.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.323 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -51.98 -50.35 61.45 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.063 0.459 . . . . 10.0 110.943 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 56.7 mm-40 -68.13 -49.53 60.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.146 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 91.1 mt -58.27 -43.86 88.16 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.662 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.09 96.5 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.335 -0.706 . . . . 10.0 111.335 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -73.08 -28.59 62.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.625 0.25 . . . . 10.0 110.72 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 70.1 mmtt -66.67 -28.0 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.644 -0.253 . . . . 10.0 111.467 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 23.1 mt -85.8 -16.24 39.41 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.096 -0.242 . . . . 10.0 111.54 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.486 -0.769 . . . . 10.0 110.715 -179.194 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 120.796 0.332 . . . . 10.0 110.169 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.41 154.55 18.97 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.04 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.414 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 19.0 t70 -62.53 -56.07 21.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.361 0.601 . . . . 10.0 109.711 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.414 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 13.3 mmmm -131.96 95.01 3.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.256 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.508 HD23 ' H71' ' C' ' 14' ' ' ' DT' . 20.9 tp -65.77 149.5 50.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.598 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -76.51 132.99 39.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.405 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.415 ' HB3' ' H73' ' C' ' 14' ' ' ' DT' . 9.6 p90 -160.09 167.5 27.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.45 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.7 tp10 -153.07 129.18 10.4 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . 0.405 ' HA ' HG12 ' B' ' 30' ' ' VAL . 68.7 mt -78.03 111.24 14.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.348 0.594 . . . . 10.0 110.555 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 mm -78.77 -41.52 24.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.776 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -169.14 139.21 2.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.34 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.74 141.45 30.53 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 83.5 mt -111.02 -70.46 0.81 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.139 -0.624 . . . . 10.0 111.617 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 18.3 mm -132.86 139.61 49.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.061 0.458 . . . . 10.0 111.582 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.7 p -124.62 123.61 66.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 107.807 -1.182 . . . . 10.0 107.807 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 41.4 mt -92.73 -81.85 0.34 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.391 -0.524 . . . . 10.0 111.803 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.34 -170.45 0.22 Allowed 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 -179.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -102.84 139.39 38.47 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -79.08 -171.46 2.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.84 -17.82 65.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.431 0.634 . . . . 10.0 111.055 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -99.3 5.87 46.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.76 3.51 90.47 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.529 -0.843 . . . . 10.0 111.181 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -61.78 104.11 0.41 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.885 0.374 . . . . 10.0 111.039 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.7 tpp85 -82.82 100.0 10.05 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.621 179.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -82.11 117.47 22.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.899 0.381 . . . . 10.0 110.758 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -131.67 146.78 52.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.08 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 44.3 tp -117.56 107.16 13.93 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -135.22 161.81 34.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.498 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -99.43 115.05 28.37 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.405 HG12 ' HA ' ' B' ' 9' ' ' ILE . 23.0 m -124.63 159.37 30.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.76 -178.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.45 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.4 p -95.8 124.01 39.63 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.306 179.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -63.84 112.64 2.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.678 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 58.63 29.46 18.55 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.472 -177.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 62.94 32.96 15.35 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.068 -0.969 . . . . 10.0 111.099 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.06 -70.7 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.95 0.352 . . . . 10.0 111.95 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -92.46 113.59 59.84 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.738 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.07 119.95 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.393 2.062 . . . . 10.0 110.753 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.4 ttpt -148.9 163.9 36.08 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.709 0.29 . . . . 10.0 110.37 -178.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -87.63 135.57 33.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.922 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.422 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -149.13 132.22 16.3 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . 0.428 ' HB ' HD12 ' B' ' 27' ' ' LEU . 8.9 tt -106.84 123.58 61.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.206 0.527 . . . . 10.0 109.855 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.53 HH21 H2'' ' C' ' 14' ' ' ' DT' . 2.7 mtt85 -144.56 179.78 7.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.234 -177.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -126.23 144.87 50.62 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.037 -0.528 . . . . 10.0 109.954 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 36.4 m95 -117.8 174.52 6.13 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.039 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -79.08 160.08 71.84 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.713 -0.477 . . . . 10.0 109.713 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.63 -27.23 84.45 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.193 1.929 . . . . 10.0 112.103 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -95.78 -4.33 44.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.272 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.06 31.81 20.76 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.117 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -89.18 -39.77 13.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.982 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -131.63 173.17 11.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.872 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.421 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -150.95 172.45 15.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.772 -177.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.619 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -132.21 -159.72 9.42 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.318 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -93.65 156.97 16.4 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.083 -0.657 . . . . 10.0 112.262 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.62 -128.41 1.91 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.766 -0.934 . . . . 10.0 110.766 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -146.84 143.47 20.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 117.618 0.709 . . . . 10.0 110.796 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -100.83 144.52 29.68 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.771 -0.649 . . . . 10.0 111.642 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -123.62 127.29 48.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.051 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' SER . . . . . 0.46 ' HG ' ' CD ' ' B' ' 61' ' ' GLU . 1.4 m -77.03 165.98 23.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.142 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -59.82 -47.69 84.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.524 ' O ' HG21 ' B' ' 64' ' ' VAL . 11.0 pt-20 -65.65 -43.74 88.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.897 0.38 . . . . 10.0 110.866 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.46 ' CD ' ' HG ' ' B' ' 58' ' ' SER . 73.0 mt-10 -62.41 -47.37 84.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.414 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.406 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.0 t80 -61.96 -41.36 97.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.727 -0.67 . . . . 10.0 110.612 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.59 -53.28 47.33 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.197 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.524 HG21 ' O ' ' B' ' 60' ' ' GLU . 23.3 t -61.33 -47.47 93.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 10.0 110.216 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.5 tp -53.62 -51.62 62.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.889 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.439 HD23 ' HB3' ' A' ' 69' ' ' LEU . 56.6 mt -61.07 -48.61 80.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.139 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -52.05 -51.21 59.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.463 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' B' ' 64' ' ' VAL . 58.9 mm-40 -66.57 -50.73 62.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.67 -0.695 . . . . 10.0 111.582 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.421 HD11 ' CD2' ' A' ' 66' ' ' LEU . 95.6 mt -60.58 -40.74 92.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.952 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.54 -40.81 99.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.51 -0.853 . . . . 10.0 111.092 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -72.0 -28.68 63.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.644 0.259 . . . . 10.0 111.215 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -66.01 -26.45 67.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.593 0.22 . . . . 10.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 21.0 mt -90.07 -10.27 45.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.944 -0.303 . . . . 10.0 111.514 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.425 -0.798 . . . . 10.0 109.89 179.712 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.513 -0.55 0 C3'-C2'-C1' 101.628 -0.766 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.563 ' H71' ' OG1' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 C3'-C2'-C1' 101.383 -0.941 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.478 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.885 0 O4'-C1'-C2' 104.132 -1.789 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.683 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 O4'-C4'-C3' 103.481 -2.119 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.465 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.796 0 O4'-C4'-C3' 103.452 -2.148 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.846 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.52 -0.797 0 C5'-C4'-O4' 113.203 2.377 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.476 " H2'" ' NZ ' ' A' ' 38' ' ' LYS . . . . . . . . 0 O5'--C5' 1.425 -0.951 0 C3'-C2'-C1' 101.306 -0.996 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.867 0 C3'-C2'-C1' 101.51 -0.85 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.443 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 C3'-C2'-C1' 101.877 -0.588 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.443 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.862 0 O4'-C1'-C2' 104.353 -1.589 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.669 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 O4'-C4'-C3' 103.555 -2.045 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.486 ' H72' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.425 -0.927 0 O4'-C4'-C3' 103.631 -1.969 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.848 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.737 0 C5'-C4'-O4' 113.026 2.266 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.996 0 C3'-C2'-C1' 101.195 -1.075 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 121.003 0.43 . . . . 10.0 110.564 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.44 172.67 7.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.024 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -74.7 -51.8 13.31 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.742 -0.466 . . . . 10.0 109.742 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.53 94.05 3.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.946 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.541 HD23 ' H72' ' C' ' 4' ' ' ' DT' . 25.5 tp -65.17 144.47 57.18 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 14.7 tppt? -78.1 130.84 36.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.932 0.396 . . . . 10.0 110.471 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.633 ' CD1' ' H71' ' C' ' 4' ' ' ' DT' . 11.3 p90 -157.0 172.33 18.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.644 179.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -154.88 134.76 12.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 56.4 mt -82.87 111.65 19.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 10.0 110.56 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.12 -47.66 19.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.507 -0.769 . . . . 10.0 110.201 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -160.99 130.82 4.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.001 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.61 129.07 35.14 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.554 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 55.8 mt -98.95 -75.66 0.55 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.285 -0.566 . . . . 10.0 111.632 -178.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.516 HD12 ' O ' ' A' ' 13' ' ' LEU . 28.8 mm -134.39 141.11 44.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.992 0.425 . . . . 10.0 112.029 -177.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 p -121.8 122.67 67.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.087 -1.079 . . . . 10.0 108.087 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.403 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -90.78 -80.65 0.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.303 -0.559 . . . . 10.0 111.882 -177.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -175.17 -167.62 0.28 Allowed 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.469 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 3.5 mp0 -115.84 134.77 54.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.792 0.33 . . . . 10.0 110.338 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -73.12 -174.2 1.49 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.15 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.432 ' O ' ' H71' ' C' ' 1' ' ' ' DT' . . . -63.51 -26.12 68.56 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 121.553 0.692 . . . . 10.0 110.418 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.404 ' HB3' " C2'" ' C' ' 1' ' ' ' DT' . 23.0 mttt -85.24 -2.04 57.61 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.0 -1.0 . . . . 10.0 110.868 -179.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.75 6.19 83.12 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.76 -0.936 . . . . 10.0 110.76 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.469 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.3 m0 -62.01 103.66 0.39 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.031 0.443 . . . . 10.0 111.513 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.545 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.6 tpp85 -80.88 99.1 8.16 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.29 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.495 ' HZ3' ' CD ' ' B' ' 61' ' ' GLU . 90.8 mttt -83.2 113.26 20.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.064 0.459 . . . . 10.0 110.614 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -132.01 150.06 52.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.416 -0.811 . . . . 10.0 111.238 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.554 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 44.6 tp -117.85 109.34 16.43 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.664 -1.236 . . . . 10.0 107.664 178.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -134.76 156.94 47.97 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.087 0.47 . . . . 10.0 111.326 -177.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.1 ttm180 -96.85 114.55 26.19 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 10.0 108.781 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 m -126.73 159.98 35.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.8 0.334 . . . . 10.0 110.943 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.454 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.0 OUTLIER -95.62 122.99 38.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.316 179.125 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -64.47 111.43 2.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.897 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.407 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.2 m-80 59.47 29.07 18.59 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.816 0.698 . . . . 10.0 110.286 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.4 t0 66.72 24.42 9.97 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.468 -1.242 . . . . 10.0 111.143 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.69 -91.58 0.44 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.534 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -83.88 123.92 75.34 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.722 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.9 Cg_endo -82.29 122.59 3.72 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.025 2.483 . . . . 10.0 111.701 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -142.89 164.56 29.75 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.769 -0.373 . . . . 10.0 110.128 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -89.35 128.86 35.94 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.422 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -139.71 131.46 27.45 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.411 ' HB ' HD12 ' A' ' 27' ' ' LEU . 9.5 tt -108.0 121.28 60.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.521 0.676 . . . . 10.0 109.952 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.459 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.5 mtt85 -144.75 -178.14 5.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.069 -177.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.545 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -126.11 144.41 50.75 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.781 179.499 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -117.14 179.75 3.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.894 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 p -81.95 161.37 60.88 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 -32.19 93.68 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.292 1.995 . . . . 10.0 112.156 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.96 -5.96 54.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.403 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 62.12 36.26 15.25 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.545 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -93.89 -40.48 10.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.857 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -126.94 172.26 10.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.448 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.444 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -152.45 173.34 15.24 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.35 -177.762 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.576 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -134.06 -161.37 9.59 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.263 -0.97 . . . . 10.0 112.589 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -89.87 154.83 19.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.003 0.43 . . . . 10.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.403 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.35 -128.02 1.52 Allowed Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.163 -0.926 . . . . 10.0 111.156 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -143.33 143.5 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 117.755 0.777 . . . . 10.0 111.192 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.528 ' HB ' ' H73' ' C' ' 7' ' ' ' DT' . 0.7 OUTLIER -107.06 140.81 39.28 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.323 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.39 128.71 49.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.544 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 69.8 m -84.34 170.24 13.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.492 -0.322 . . . . 10.0 110.551 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -52.9 -51.94 59.39 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.106 0.78 . . . . 10.0 113.106 -178.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.99 -46.67 86.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.743 0.306 . . . . 10.0 111.463 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.506 ' CD ' ' HZ3' ' B' ' 25' ' ' LYS . 47.8 mt-10 -62.07 -48.73 78.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.21 0.528 . . . . 10.0 110.67 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -61.77 -43.11 99.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.217 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.68 -52.41 53.21 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.862 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.7 t -60.62 -41.55 88.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.14 0.495 . . . . 10.0 110.083 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.481 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.7 tp -59.11 -55.25 37.42 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.422 -0.808 . . . . 10.0 110.667 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.443 HD21 ' HB3' ' B' ' 69' ' ' LEU . 16.5 mt -59.45 -47.02 87.09 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -48.86 -55.59 11.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.593 -0.73 . . . . 10.0 111.626 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.491 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 62.6 mm-40 -72.28 -41.99 66.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.768 -178.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.0 mt -59.66 -45.89 90.67 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.637 0.256 . . . . 10.0 111.583 -179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.06 -36.78 93.41 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.367 -0.921 . . . . 10.0 111.076 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -67.55 -25.0 65.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 10.0 110.891 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.7 mmtt -72.37 -26.88 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.447 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.412 HD11 ' HB3' ' B' ' 66' ' ' LEU . 35.2 mt -88.14 -18.74 28.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.637 0.256 . . . . 10.0 111.009 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.594 -0.717 . . . . 10.0 111.044 -179.529 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.897 0.38 . . . . 10.0 110.425 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.82 167.06 10.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -70.82 -53.98 13.29 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 20.7 mmtm -132.76 94.26 3.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.835 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.606 HD21 ' H73' ' C' ' 14' ' ' ' DT' . 27.2 tp -65.57 142.23 58.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.808 0.337 . . . . 10.0 110.268 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.431 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.9 tppt? -75.26 126.98 32.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.58 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.569 ' CD1' ' H71' ' C' ' 14' ' ' ' DT' . 10.9 p90 -153.01 171.69 17.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.914 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.523 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.7 tp10 -155.15 132.01 10.73 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 53.4 mt -81.22 114.46 22.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.203 0.525 . . . . 10.0 110.633 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.1 mm -86.42 -41.0 14.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -166.17 130.04 2.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.651 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.86 132.24 39.05 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.736 -0.838 . . . . 10.0 108.736 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 29.3 mt -102.97 -72.91 0.68 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.384 -0.526 . . . . 10.0 111.76 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.431 HD11 ' CB ' ' A' ' 68' ' ' GLU . 14.0 mm -136.66 137.94 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.918 0.389 . . . . 10.0 112.016 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 p -119.0 122.98 70.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.6 mt -90.67 -80.34 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.599 -0.44 . . . . 10.0 111.433 -178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -177.06 -167.18 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.494 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.3 mt-10 -115.78 136.43 53.06 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.924 -0.398 . . . . 10.0 109.924 179.022 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -74.14 -175.35 2.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.214 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.83 -25.64 68.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.289 0.566 . . . . 10.0 110.751 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -86.12 0.51 53.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.52 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 6.36 85.14 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.284 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.494 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -62.5 104.31 0.5 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.971 0.415 . . . . 10.0 111.705 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.534 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.2 tpp85 -80.56 99.57 8.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.272 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.506 ' HZ3' ' CD ' ' A' ' 61' ' ' GLU . 91.5 mttt -83.2 114.09 21.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.969 0.414 . . . . 10.0 110.798 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -133.67 151.56 51.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.538 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 48.3 tp -119.01 109.07 15.51 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.539 -1.282 . . . . 10.0 107.539 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -133.95 156.59 47.87 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.152 0.501 . . . . 10.0 111.209 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -96.71 114.33 25.96 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.5 m -126.65 160.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.86 0.362 . . . . 10.0 110.86 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.523 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -96.53 123.02 40.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.371 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.575 ' CH2' ' H71' ' C' ' 17' ' ' ' DT' . 10.0 m0 -64.07 111.23 2.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.903 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 66.2 m-80 60.12 29.32 18.91 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.064 -178.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.8 t70 69.38 16.04 8.35 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.176 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.15 -93.56 0.32 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.164 0.431 . . . . 10.0 112.164 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -80.03 122.62 83.32 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.792 0.33 . . . . 10.0 111.751 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.493 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 82.9 Cg_endo -82.16 124.38 4.3 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.894 2.396 . . . . 10.0 111.591 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -143.78 165.69 26.98 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -91.14 128.7 37.06 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.443 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t0 -139.15 130.19 26.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 9.2 tt -106.18 121.55 58.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 121.441 0.638 . . . . 10.0 109.934 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.493 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.1 mtt85 -144.88 -178.07 5.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.257 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.534 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -125.85 144.77 50.52 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.123 -0.489 . . . . 10.0 109.937 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -117.41 179.54 4.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.12 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.73 161.75 57.59 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.42 -35.28 96.19 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.312 2.008 . . . . 10.0 112.082 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -89.17 -5.47 57.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.549 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.55 37.24 16.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.898 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -94.04 -39.7 10.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.632 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -128.77 169.87 14.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.015 0.436 . . . . 10.0 110.942 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.445 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -149.68 172.83 14.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.343 -177.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.548 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -133.72 -162.83 10.19 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.959 -0.638 . . . . 10.0 112.212 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -89.11 153.45 20.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.202 0.525 . . . . 10.0 112.197 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.414 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -147.32 -128.73 1.87 Allowed Glycine 0 C--N 1.331 0.282 0 N-CA-C 110.645 -0.982 . . . . 10.0 110.645 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -143.37 141.97 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 117.665 0.733 . . . . 10.0 111.13 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.11 142.25 35.22 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.254 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -125.76 126.45 44.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.582 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.9 m -79.92 171.52 15.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.25 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -55.85 -52.51 63.78 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.301 0.482 . . . . 10.0 112.301 -178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.544 ' O ' HG21 ' B' ' 64' ' ' VAL . 11.3 pt-20 -60.88 -44.59 96.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.787 0.327 . . . . 10.0 111.447 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.495 ' CD ' ' HZ3' ' A' ' 25' ' ' LYS . 52.1 mt-10 -64.39 -49.59 71.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.001 0.429 . . . . 10.0 110.848 -179.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -62.65 -39.32 93.51 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.908 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.97 -54.02 40.92 Favored Glycine 0 C--N 1.328 0.128 0 C-N-CA 121.163 -0.541 . . . . 10.0 112.961 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.544 HG21 ' O ' ' B' ' 60' ' ' GLU . 13.0 t -61.36 -39.68 83.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.161 0.505 . . . . 10.0 109.904 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.0 tp -59.87 -55.11 38.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.278 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.412 ' HB3' HD11 ' A' ' 73' ' ' LEU . 75.5 mt -58.03 -49.47 76.74 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.212 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.7 tttm -49.14 -57.18 7.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.016 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 65.5 mm-40 -70.48 -42.91 70.77 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.24 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.443 ' HB3' HD21 ' A' ' 66' ' ' LEU . 49.0 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.609 0.226 . . . . 10.0 111.609 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.95 -35.66 92.29 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . 0.404 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 10.6 t-20 -70.3 -27.26 64.25 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.951 0.405 . . . . 10.0 111.143 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 52.1 mmtt -69.0 -27.11 65.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.594 -0.276 . . . . 10.0 111.59 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 27.6 mt -89.91 -5.81 56.39 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.774 -0.37 . . . . 10.0 111.63 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.404 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.2 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.663 -0.684 . . . . 10.0 110.362 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.432 ' H71' ' O ' ' A' ' 20' ' ' ALA . . . . . . . . 0 C2'--C1' 1.514 -0.529 0 C3'-C2'-C1' 101.698 -0.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.525 ' H72' ' OG1' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.427 -0.809 0 C3'-C2'-C1' 101.53 -0.836 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.921 0 O4'-C1'-C2' 104.256 -1.676 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.676 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.521 -0.706 0 O4'-C4'-C3' 103.567 -2.033 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.507 H5'' HD11 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C4'-C3' 103.45 -2.15 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.777 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.865 0 C5'-C4'-O4' 113.119 2.325 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.528 ' H73' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 101.171 -1.092 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.999 0 C3'-C2'-C1' 101.449 -0.894 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.04 0 C3'-C2'-C1' 101.923 -0.555 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.431 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.409 -0.829 0 O4'-C1'-C2' 104.38 -1.564 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.619 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.519 -0.932 0 O4'-C4'-C3' 103.52 -2.08 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.532 H5'' HD12 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.896 0 O4'-C4'-C3' 103.814 -1.786 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.797 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.531 0.746 0 C5'-C4'-O4' 113.068 2.293 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.575 ' H71' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 101.142 -1.113 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.622 0.249 . . . . 10.0 110.749 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.14 150.25 25.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.519 -0.548 . . . . 10.0 109.519 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.462 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 36.8 t70 -63.35 -41.16 98.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.846 0.355 . . . . 10.0 110.574 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 21.3 mmtm -135.79 103.56 5.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.062 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.583 HD22 ' H71' ' C' ' 4' ' ' ' DT' . 23.0 tp -87.31 142.2 28.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 29.6 tptt -75.28 126.32 30.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.29 0.567 . . . . 10.0 110.744 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.514 ' HB3' ' H73' ' C' ' 4' ' ' ' DT' . 12.3 p90 -146.34 169.71 18.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.637 -0.711 . . . . 10.0 109.154 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.471 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.0 tp10 -153.84 122.1 6.14 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.406 ' HA ' HG11 ' A' ' 30' ' ' VAL . 64.4 mt -73.23 112.97 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.078 0.466 . . . . 10.0 110.362 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -85.16 -42.76 16.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.144 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -165.48 134.23 3.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.853 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -85.71 133.25 34.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.4 mt -102.15 -75.8 0.59 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.5 -0.48 . . . . 10.0 111.9 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.471 HD13 ' O ' ' A' ' 13' ' ' LEU . 35.6 mm -131.74 137.27 55.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.568 0.581 . . . . 10.0 112.568 -177.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 p -116.31 120.68 65.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.219 -1.03 . . . . 10.0 108.219 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.3 mt -87.77 -81.44 0.24 Allowed 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.386 -0.526 . . . . 10.0 111.768 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m -178.29 -168.69 0.16 Allowed 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.622 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 14.8 mp0 -114.48 139.04 49.87 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.204 0.315 . . . . 10.0 110.924 179.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -76.1 -171.81 1.82 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.318 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.92 -26.45 68.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.311 0.577 . . . . 10.0 111.173 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.582 ' HD3' H2'' ' C' ' 1' ' ' ' DT' . 47.1 mttt -88.51 1.8 54.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.361 -0.836 . . . . 10.0 111.133 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.24 4.38 88.16 Favored Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.622 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 37.9 m0 -57.74 107.96 0.51 Allowed 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.259 -0.47 . . . . 10.0 111.911 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.9 tpp85 -86.86 104.86 16.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.889 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -91.68 117.41 29.72 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.277 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -135.55 147.86 48.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.466 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 39.4 tp -114.02 108.18 16.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.11 -0.95 . . . . 10.0 108.578 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -135.1 169.24 17.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.933 0.397 . . . . 10.0 110.832 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.438 ' HD3' ' CE1' ' A' ' 39' ' ' TYR . 10.0 ttp180 -108.86 118.01 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.406 HG11 ' HA ' ' A' ' 9' ' ' ILE . 13.9 m -127.16 161.33 34.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.724 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.471 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.8 p -96.48 123.58 40.19 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.217 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.515 ' CH2' ' H72' ' C' ' 7' ' ' ' DT' . 7.9 m0 -64.4 109.25 1.86 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.714 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.407 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.5 m-80 62.1 23.96 14.2 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.301 0.572 . . . . 10.0 109.826 -178.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t0 66.6 23.68 10.3 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.521 -1.218 . . . . 10.0 111.088 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.47 -79.64 0.52 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.901 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -98.32 125.05 44.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.583 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.0 Cg_endo -82.21 125.88 4.74 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.801 2.334 . . . . 10.0 111.66 178.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.2 ttmm -146.38 163.92 34.08 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.438 ' CE1' ' HD3' ' A' ' 29' ' ' ARG . 7.6 m-85 -84.68 129.65 34.81 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.188 -0.301 . . . . 10.0 110.188 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.453 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -143.32 127.32 17.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.419 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -105.09 123.41 59.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 CA-C-O 121.154 0.502 . . . . 10.0 109.729 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.511 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtp85 -142.91 -179.17 6.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.389 0.614 . . . . 10.0 112.27 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.604 ' CG2' ' HB3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -124.26 135.75 53.64 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.715 -1.129 . . . . 10.0 110.404 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -122.37 165.34 16.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.721 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -67.98 152.53 96.34 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.121 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.19 -35.88 95.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.85 2.367 . . . . 10.0 113.109 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.48 -4.92 59.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.949 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 63.0 28.94 16.43 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.833 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -79.18 -35.41 41.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.705 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.3 mmmm -141.08 174.55 10.41 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.328 0.585 . . . . 10.0 111.63 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.507 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -135.57 168.06 19.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.888 -1.051 . . . . 10.0 110.889 -178.202 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.625 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -132.38 -171.77 12.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.056 -0.593 . . . . 10.0 112.144 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.7 mttp -90.97 151.62 21.01 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.154 -0.615 . . . . 10.0 111.838 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.07 -123.48 1.44 Allowed Glycine 0 C--N 1.333 0.398 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.6 141.07 15.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 121.366 0.603 . . . . 10.0 111.751 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.508 ' HB ' ' H71' ' C' ' 7' ' ' ' DT' . 1.0 OUTLIER -100.72 143.41 30.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.75 179.663 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.5 mt -119.77 128.4 53.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.378 -0.373 . . . . 10.0 110.258 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.413 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 1.8 m -76.16 162.93 27.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -56.64 -48.66 77.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.024 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -64.26 -43.39 95.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.004 0.431 . . . . 10.0 110.717 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.416 ' CD ' ' HZ3' ' B' ' 25' ' ' LYS . 93.8 mt-10 -61.15 -51.89 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.289 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.41 -36.75 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.65 -52.49 52.16 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 121.201 -0.523 . . . . 10.0 112.032 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.1 t -64.63 -41.96 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.957 0.408 . . . . 10.0 110.075 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 13.0 tp -56.46 -52.86 63.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.443 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.477 ' HB3' ' CD1' ' B' ' 73' ' ' LEU . 19.0 mt -62.07 -47.04 86.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.917 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -50.48 -52.91 33.93 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.558 0.536 . . . . 10.0 111.115 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.653 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 7.5 mm-40 -70.35 -51.51 29.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.649 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.442 ' HB3' HD22 ' B' ' 66' ' ' LEU . 72.8 mt -55.37 -45.89 76.53 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -178.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.48 -39.27 97.08 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.688 -0.768 . . . . 10.0 111.34 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -72.89 -26.77 61.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.82 0.343 . . . . 10.0 110.882 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.653 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 40.5 mmtt -67.32 -30.21 69.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.548 -0.296 . . . . 10.0 110.479 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.0 mt -77.34 -22.2 52.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.274 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.629 -0.7 . . . . 10.0 110.389 -179.714 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.965 0.412 . . . . 10.0 110.315 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.39 150.77 23.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.22 -0.446 . . . . 10.0 109.817 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.452 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 29.0 t70 -63.79 -41.34 97.95 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.116 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.452 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 31.1 mmtm -134.35 104.82 6.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.952 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.465 HD21 ' H73' ' C' ' 14' ' ' ' DT' . 23.7 tp -88.2 141.4 28.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 28.4 tptt -75.81 124.66 27.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.418 0.628 . . . . 10.0 110.66 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.555 ' CD1' ' H72' ' C' ' 14' ' ' ' DT' . 9.5 p90 -144.58 168.37 20.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.22 -0.9 . . . . 10.0 108.839 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.46 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 12.7 tp10 -151.68 119.71 6.25 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 63.8 mt -70.86 110.79 4.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.066 0.46 . . . . 10.0 110.275 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 34.7 mm -83.44 -43.45 18.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.278 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -164.08 132.92 3.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.953 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -83.9 135.04 34.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 62.7 mt -105.51 -74.74 0.64 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.547 -0.461 . . . . 10.0 111.845 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.417 HD12 HG21 ' B' ' 14' ' ' ILE . 17.5 mm -130.77 137.23 56.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -117.56 118.14 57.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.168 -1.049 . . . . 10.0 108.168 177.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -86.68 -81.69 0.22 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.441 -0.504 . . . . 10.0 111.716 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.68 -168.83 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.835 0.454 . . . . 10.0 109.81 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.626 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 15.7 mp0 -113.59 141.53 47.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.517 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -76.98 -169.41 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.764 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.21 -20.71 64.86 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.142 0.496 . . . . 10.0 111.041 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . 0.613 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 42.4 mttt -91.51 1.32 57.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.694 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.46 3.01 84.63 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.006 -0.838 . . . . 10.0 111.006 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.626 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 38.1 m0 -57.07 108.96 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.315 -0.443 . . . . 10.0 112.152 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.2 tpp85 -87.5 105.52 17.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.132 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.416 ' HZ3' ' CD ' ' A' ' 61' ' ' GLU . 70.2 mttt -91.82 116.47 28.93 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.945 0.402 . . . . 10.0 110.465 179.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -134.51 146.87 50.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.069 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.537 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 38.4 tp -113.73 108.41 17.07 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -134.89 169.1 17.9 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.856 0.36 . . . . 10.0 110.736 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.528 ' HD3' ' CE1' ' B' ' 39' ' ' TYR . 14.3 ttp180 -108.94 115.63 30.44 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.5 m -125.14 161.74 28.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.751 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.2 p -96.56 123.82 40.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.319 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.02 110.06 2.01 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.292 -0.632 . . . . 10.0 109.292 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.441 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.44 26.95 16.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.479 0.656 . . . . 10.0 110.039 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 39.2 t0 63.27 25.46 14.74 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.623 -1.171 . . . . 10.0 110.839 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -78.85 0.56 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.767 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.522 ' OE1' H2'' ' C' ' 17' ' ' ' DT' . 35.1 tt0 -99.08 122.59 51.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-O 120.697 0.284 . . . . 10.0 111.666 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.485 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.5 Cg_endo -80.14 126.97 6.56 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.922 2.414 . . . . 10.0 112.027 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -148.1 165.27 31.34 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . 0.528 ' CE1' ' HD3' ' B' ' 29' ' ' ARG . 7.0 m-85 -85.64 128.78 34.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.268 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.431 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 11.3 t0 -143.04 127.46 17.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . 0.407 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.9 tt -105.47 123.28 59.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.532 HH21 H2'' ' C' ' 14' ' ' ' DT' . 4.8 mtp85 -143.12 -179.22 6.25 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.407 0.622 . . . . 10.0 112.373 -177.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.599 ' CG2' ' HB3' ' B' ' 23' ' ' TRP . 0.2 OUTLIER -123.73 136.72 54.61 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.263 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -122.5 166.39 14.86 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.624 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -69.69 152.52 96.14 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 10.0 109.953 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.02 -40.46 81.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.926 2.418 . . . . 10.0 113.0 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -84.98 -5.26 59.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 10.0 110.859 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 66.27 24.3 10.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.375 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -72.02 -38.93 69.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.823 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -138.5 174.55 10.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.467 0.651 . . . . 10.0 111.853 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.496 ' O ' " H1'" ' C' ' 13' ' ' ' DT' . 0.0 OUTLIER -135.49 166.98 21.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.671 -1.15 . . . . 10.0 110.631 -178.131 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.631 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -131.2 -169.28 12.39 Favored Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.126 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -92.33 146.92 23.33 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.169 -0.606 . . . . 10.0 111.914 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.22 -125.31 2.1 Favored Glycine 0 N--CA 1.453 -0.221 0 N-CA-C 110.7 -0.96 . . . . 10.0 110.7 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.1 tt -151.93 139.47 13.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 117.684 0.742 . . . . 10.0 111.55 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.54 141.47 31.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.887 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 76.5 mt -118.45 129.32 55.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.486 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' SER . . . . . 0.406 ' HG ' ' CD ' ' B' ' 61' ' ' GLU . 3.7 m -73.67 164.58 26.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -60.08 -48.21 82.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.467 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.403 ' O ' HG21 ' B' ' 64' ' ' VAL . 14.7 pt-20 -63.53 -41.0 98.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.041 0.448 . . . . 10.0 110.739 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.406 ' CD ' ' HG ' ' B' ' 58' ' ' SER . 88.1 mt-10 -63.49 -53.22 55.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.918 -179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -61.08 -36.78 80.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.291 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.51 -52.7 50.97 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.204 -0.522 . . . . 10.0 112.102 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.403 HG21 ' O ' ' B' ' 60' ' ' GLU . 60.5 t -64.02 -43.22 97.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.043 0.449 . . . . 10.0 109.887 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.52 -52.7 62.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.569 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.442 HD22 ' HB3' ' A' ' 69' ' ' LEU . 44.0 mt -60.6 -49.57 77.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.462 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -50.09 -54.07 22.97 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 123.523 0.515 . . . . 10.0 111.363 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.625 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 6.3 mm-40 -69.19 -52.98 22.45 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.655 -178.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 61.0 mt -56.36 -44.57 80.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -178.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.98 -38.62 95.79 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.972 -0.633 . . . . 10.0 111.644 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . 0.461 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.1 t-20 -75.67 -23.07 56.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.806 0.336 . . . . 10.0 111.013 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.625 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.1 mmtt -69.83 -26.07 64.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.507 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.477 ' CD1' ' HB3' ' A' ' 66' ' ' LEU . 22.0 mt -84.85 -12.57 53.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.974 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.461 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.9 mt-10 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.619 -0.705 . . . . 10.0 110.246 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.582 H2'' ' HD3' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 O5'-C5'-C4' 109.108 -0.78 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.436 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.847 0 C3'-C2'-C1' 101.22 -1.057 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.507 " H1'" ' O ' ' A' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.408 -0.951 0 O4'-C1'-C2' 103.616 -2.259 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.715 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.52 -0.773 0 O4'-C4'-C3' 103.814 -1.786 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.481 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -1.002 0 O4'-C4'-C3' 103.482 -2.118 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.85 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.815 0 C5'-C4'-O4' 113.326 2.454 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.515 ' H72' ' CH2' ' A' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 C3'-C2'-C1' 100.971 -1.235 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . 0.613 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 C3'-C2'-C1' 101.106 -1.138 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.424 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.933 0 C3'-C2'-C1' 101.636 -0.76 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.496 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O5'--C5' 1.426 -0.892 0 O4'-C1'-C2' 103.952 -1.953 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.631 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.426 -0.893 0 O4'-C4'-C3' 103.707 -1.893 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.498 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.422 -1.13 0 O4'-C4'-C3' 103.945 -1.655 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.818 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.905 0 C5'-C4'-O4' 113.275 2.422 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.522 H2'' ' OE1' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 C3'-C2'-C1' 100.961 -1.242 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 mmt . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.83 0.348 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.0 171.86 7.25 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.482 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 34.3 t70 -71.15 -50.61 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.9 -0.408 . . . . 10.0 109.9 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.482 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 45.8 mmtm -140.66 120.86 13.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.668 178.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.736 HD12 H5'' ' C' ' 5' ' ' ' DT' . 23.3 tp -92.87 138.74 31.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -72.03 128.71 36.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.459 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -156.11 163.17 39.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.47 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 6.7 tp10 -145.64 134.57 22.52 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.262 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.3 mt -84.3 110.36 18.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.402 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 41.2 mm -78.52 -47.62 23.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.763 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -162.32 134.62 5.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.905 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.62 137.26 37.76 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.521 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 72.2 mt -106.32 -75.94 0.62 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.157 -0.617 . . . . 10.0 111.44 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.473 HD13 ' O ' ' A' ' 13' ' ' LEU . 26.5 mm -132.93 139.35 49.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -177.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -117.04 125.72 74.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 107.805 -1.183 . . . . 10.0 107.805 177.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.461 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.8 mt -95.66 -81.12 0.41 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.984 -0.686 . . . . 10.0 112.033 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 m -176.35 -165.18 0.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.553 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 17.9 mt-10 -117.43 143.73 45.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.855 0.36 . . . . 10.0 110.53 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -80.21 -176.68 5.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.678 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.57 -21.43 66.34 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.607 0.718 . . . . 10.0 110.711 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.441 ' HD3' H2'' ' C' ' 1' ' ' ' DT' . 43.3 mttt -87.23 -6.31 58.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.087 -0.961 . . . . 10.0 110.556 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.23 3.46 72.6 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.076 -0.81 . . . . 10.0 111.076 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.553 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.4 m0 -60.77 108.15 0.81 Allowed 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.742 -0.229 . . . . 10.0 111.345 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.467 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.8 tpp85 -84.05 100.26 10.98 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 80.0 mttt -84.51 114.15 21.74 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.75 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -134.06 147.73 50.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.875 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 37.2 tp -115.34 110.56 19.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.232 -0.895 . . . . 10.0 108.623 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.57 159.31 40.84 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.051 0.453 . . . . 10.0 111.304 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -95.75 113.94 25.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.9 m -126.85 159.33 36.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.94 0.4 . . . . 10.0 110.868 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.47 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.3 p -96.8 123.72 40.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.471 179.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.5 m0 -63.62 108.64 1.44 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.489 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.44 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.3 m-80 59.61 28.93 18.45 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.107 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 63.67 26.9 14.7 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 114.927 -1.033 . . . . 10.0 111.229 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.88 -70.49 0.79 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.646 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -95.12 112.83 59.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.573 -0.285 . . . . 10.0 111.726 -178.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 6.3 Cg_exo -77.06 120.38 5.39 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.018 2.479 . . . . 10.0 110.909 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.415 ' HE3' ' CG2' ' A' ' 56' ' ' THR . 19.5 ttpt -148.89 166.55 28.23 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.733 -0.387 . . . . 10.0 110.61 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -90.26 134.48 34.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.64 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.416 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.57 132.97 18.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.9 tt -109.78 122.84 65.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 121.321 0.581 . . . . 10.0 109.802 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.422 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.2 mtt85 -144.9 179.73 7.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.197 -178.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.476 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -125.1 144.21 50.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.256 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -117.78 171.03 8.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.798 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 m -70.28 157.55 89.65 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.92 -29.22 88.91 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.248 1.965 . . . . 10.0 112.016 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -94.34 -1.07 54.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.811 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 61.78 27.01 16.47 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.127 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -76.81 -36.19 57.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.417 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -139.25 174.66 10.28 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.52 0.676 . . . . 10.0 112.304 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.4 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -136.93 172.93 12.28 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.337 -1.301 . . . . 10.0 110.302 -178.118 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.522 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -143.09 -167.38 11.53 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 120.852 -0.69 . . . . 10.0 111.969 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -93.36 147.53 22.86 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.029 -0.689 . . . . 10.0 112.241 -179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.24 -117.89 1.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.576 -1.01 . . . . 10.0 110.576 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.29 141.27 15.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 117.348 0.574 . . . . 10.0 111.031 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.415 ' CG2' ' HE3' ' A' ' 38' ' ' LYS . 1.2 m -101.85 141.32 34.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.595 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.5 mt -119.28 129.41 54.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.164 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 t -79.5 168.35 19.56 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.854 -0.425 . . . . 10.0 109.854 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -58.39 -50.5 73.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.075 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.18 -41.91 98.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.041 0.448 . . . . 10.0 110.886 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.19 -54.02 44.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.016 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.605 ' CE2' HD13 ' A' ' 66' ' ' LEU . 33.1 t80 -56.78 -43.16 80.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.352 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.28 -52.5 52.89 Favored Glycine 0 CA--C 1.519 0.292 0 C-N-CA 121.327 -0.463 . . . . 10.0 113.155 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.73 -42.56 95.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.861 0.362 . . . . 10.0 110.482 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.44 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.4 tp -56.25 -51.35 68.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.804 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.605 HD13 ' CE2' ' A' ' 62' ' ' PHE . 21.5 mt -62.67 -46.61 87.37 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.467 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.9 tttm -50.83 -54.46 23.58 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.705 0.628 . . . . 10.0 111.352 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.517 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 9.2 mm-40 -66.9 -51.23 57.93 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.801 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 81.8 mt -57.5 -45.84 84.46 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.54 -39.37 97.56 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.884 -0.674 . . . . 10.0 111.767 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -68.6 -27.47 66.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.625 0.25 . . . . 10.0 111.142 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 75.3 mmtt -69.59 -28.71 66.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.866 0.365 . . . . 10.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 32.2 mt -89.67 -2.84 58.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.323 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.656 -179.608 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 23.7 mmt . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.834 0.35 . . . . 10.0 110.144 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.31 167.55 9.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.065 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.447 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 38.0 t70 -66.79 -54.33 23.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.141 0.496 . . . . 10.0 110.026 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.447 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 42.9 mmtm -139.44 118.07 12.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.349 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.602 HD12 H5'' ' C' ' 15' ' ' ' DT' . 24.8 tp -89.03 138.65 31.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.662 0.268 . . . . 10.0 110.494 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.413 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.0 tppt? -72.1 128.34 35.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.591 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.492 ' CD1' ' H72' ' C' ' 14' ' ' ' DT' . 7.6 p90 -156.49 163.57 39.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.141 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -147.29 136.35 22.34 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.747 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -84.54 111.76 20.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.678 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.51 -45.33 23.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.176 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -165.47 131.53 2.66 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.478 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.4 139.95 41.15 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.527 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 70.0 mt -109.92 -73.69 0.68 Allowed 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.203 -0.599 . . . . 10.0 111.936 -178.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.516 HD11 ' CB ' ' A' ' 68' ' ' GLU . 16.4 mm -132.49 138.01 53.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -117.48 122.43 69.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 49.0 mt -93.25 -81.31 0.36 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.274 -0.57 . . . . 10.0 112.32 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.4 m -176.22 -166.45 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.556 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 48.6 mt-10 -117.91 140.24 49.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.684 0.278 . . . . 10.0 110.526 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -75.83 -176.01 3.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.057 -0.519 . . . . 10.0 109.927 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.9 -16.84 64.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.416 0.627 . . . . 10.0 110.785 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . 0.452 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 47.1 mttt -91.84 -4.79 54.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.375 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.7 2.07 73.0 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.621 -0.8 . . . . 10.0 111.412 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.556 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.0 m0 -59.45 107.05 0.52 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 120.805 0.335 . . . . 10.0 111.537 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.453 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.6 tpp85 -82.96 100.2 10.27 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.441 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 79.3 mttt -84.7 114.05 21.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.883 -179.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -135.22 147.4 49.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.681 . . . . 10.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.527 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 35.0 tp -114.4 110.76 20.38 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.258 -0.883 . . . . 10.0 108.906 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.73 158.94 42.03 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.038 0.446 . . . . 10.0 111.069 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -95.36 113.71 25.41 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 m -126.44 161.16 33.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.901 0.382 . . . . 10.0 110.778 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -98.52 124.24 43.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.565 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -64.08 108.13 1.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.573 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.413 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.07 29.5 19.06 Favored 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 123.783 0.677 . . . . 10.0 109.896 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 27.9 t70 63.19 22.11 13.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 114.615 -1.175 . . . . 10.0 111.299 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.14 -66.6 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.035 -0.415 . . . . 10.0 111.785 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.44 112.13 61.59 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 56.5 Cg_endo -77.18 120.19 5.27 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.219 1.946 . . . . 10.0 110.872 178.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 16.9 ttpt -147.81 170.39 17.72 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.014 -0.274 . . . . 10.0 110.509 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -93.55 133.52 36.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.673 -0.24 . . . . 10.0 110.686 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.408 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -147.11 132.2 18.28 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 11.7 tt -108.08 122.72 62.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.275 0.56 . . . . 10.0 109.907 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.488 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.6 mtt85 -145.33 177.15 9.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.377 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.47 ' OG1' ' H73' ' C' ' 12' ' ' ' DT' . 0.1 OUTLIER -122.14 144.09 49.15 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.29 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 38.2 m95 -118.01 171.66 7.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.71 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.1 m -70.8 158.06 88.85 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -59.61 -29.5 90.0 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.179 1.919 . . . . 10.0 111.691 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.96 -3.29 51.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.869 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 61.49 29.96 18.6 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.744 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.29 -34.6 31.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.166 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mmtm -137.56 174.28 10.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.321 0.581 . . . . 10.0 112.113 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.72 172.4 12.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.085 -178.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.54 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -141.95 -164.23 9.96 Favored Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.631 -0.795 . . . . 10.0 112.195 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -96.8 143.44 27.72 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.095 -0.65 . . . . 10.0 112.139 -179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -136.55 -118.49 1.76 Allowed Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 110.338 -1.105 . . . . 10.0 110.338 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -152.4 141.38 14.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 117.59 0.695 . . . . 10.0 110.926 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -100.47 142.29 32.14 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.673 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 71.6 mt -120.41 128.78 53.52 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.19 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -77.36 169.23 18.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.29 -48.43 81.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.632 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.595 ' O ' HG21 ' B' ' 64' ' ' VAL . 10.6 pt-20 -62.37 -44.3 96.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.055 0.455 . . . . 10.0 110.486 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -61.31 -54.11 48.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.614 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.405 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -58.05 -40.47 81.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.687 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.55 -51.55 58.15 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 116.024 -0.535 . . . . 10.0 112.552 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.595 HG21 ' O ' ' B' ' 60' ' ' GLU . 15.1 t -65.74 -44.67 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 120.801 0.334 . . . . 10.0 110.387 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.0 -51.75 65.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.919 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 95.9 mt -60.48 -51.1 70.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.144 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.07 -57.61 5.58 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.758 0.661 . . . . 10.0 112.142 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 9.3 mm-40 -65.85 -50.39 64.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.068 -0.514 . . . . 10.0 112.146 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.452 ' HB3' HD22 ' A' ' 66' ' ' LEU . 78.6 mt -59.59 -44.97 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -178.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.69 -37.45 94.81 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.188 -0.529 . . . . 10.0 111.921 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -71.94 -27.34 62.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.818 0.342 . . . . 10.0 111.147 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.2 mmtt -66.07 -34.17 77.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.646 0.26 . . . . 10.0 111.051 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 23.6 mt -90.64 8.81 32.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.606 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.242 -0.885 . . . . 10.0 110.575 -180.0 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.441 H2'' ' HD3' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C3'-C2'-C1' 101.603 -0.784 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.404 ' H71' ' HG1' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.846 0 C3'-C2'-C1' 101.502 -0.855 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.914 0 O4'-C1'-C2' 104.16 -1.763 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.728 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.428 0.627 0 O4'-C4'-C3' 103.429 -2.171 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.736 H5'' HD12 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.885 0 O4'-C4'-C3' 103.411 -2.189 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.847 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.909 0 C5'-C4'-O4' 113.109 2.318 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 C3'-C2'-C1' 101.011 -1.207 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . 0.452 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.872 0 C3'-C2'-C1' 101.627 -0.766 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.47 ' H73' ' OG1' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.425 -0.919 0 C3'-C2'-C1' 101.803 -0.641 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.432 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.884 0 O4'-C1'-C2' 104.436 -1.512 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.747 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.52 -0.804 0 O4'-C4'-C3' 103.569 -2.031 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.602 H5'' HD12 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.863 0 O4'-C4'-C3' 103.457 -2.143 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.837 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.917 0 C5'-C4'-O4' 113.217 2.386 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.016 0 C3'-C2'-C1' 101.252 -1.034 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 CA-C-O 120.757 0.313 . . . . 10.0 110.895 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.3 158.2 16.78 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.076 -0.342 . . . . 10.0 110.076 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -61.53 -50.06 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 10.0 110.392 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -136.47 100.45 4.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.48 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.747 ' HB3' ' H73' ' C' ' 4' ' ' ' DT' . 24.9 tp -75.61 140.52 42.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.442 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.8 tppt? -75.75 136.14 40.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.91 0.386 . . . . 10.0 110.937 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -158.92 174.85 14.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.506 -0.553 . . . . 10.0 109.506 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.449 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.0 tp10 -156.58 129.13 7.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.732 -0.469 . . . . 10.0 109.732 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.434 ' HA ' HG11 ' A' ' 30' ' ' VAL . 61.1 mt -80.75 119.02 29.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.945 0.402 . . . . 10.0 110.625 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.9 mm -90.33 -48.63 14.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.287 0.565 . . . . 10.0 110.204 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -162.38 128.43 3.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.865 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -74.72 144.65 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.844 -0.799 . . . . 10.0 108.844 178.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 80.4 mt -114.1 -72.98 0.67 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.579 -0.448 . . . . 10.0 112.096 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.409 HD13 ' O ' ' A' ' 13' ' ' LEU . 28.3 mm -131.37 140.58 48.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.472 . . . . 10.0 112.196 -177.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.1 120.07 57.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 177.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.7 mt -89.3 -80.27 0.3 Allowed 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.68 -0.408 . . . . 10.0 111.837 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 m -179.04 -166.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.679 . . . . 10.0 109.168 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.498 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.6 mp0 -112.91 144.04 43.16 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.273 0.358 . . . . 10.0 110.366 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -81.57 -173.78 4.6 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.417 ' O ' ' H71' ' C' ' 1' ' ' ' DT' . . . -64.98 -21.74 66.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.674 0.749 . . . . 10.0 110.438 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -87.71 -5.61 58.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.059 -0.973 . . . . 10.0 110.534 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.11 4.26 74.86 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.692 -0.765 . . . . 10.0 111.303 -178.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.498 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -63.14 105.15 0.66 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.817 0.341 . . . . 10.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.521 ' O ' ' HA ' ' A' ' 43' ' ' THR . 8.1 tpp85 -83.71 100.13 10.69 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.446 178.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.481 ' HZ2' ' CD ' ' B' ' 61' ' ' GLU . 88.8 mttt -82.94 114.95 21.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.112 0.482 . . . . 10.0 110.998 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -131.85 147.89 52.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.517 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.498 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 33.9 tp -118.19 109.5 16.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -133.25 161.76 33.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.026 0.441 . . . . 10.0 111.283 -178.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -96.27 113.96 25.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.153 -1.055 . . . . 10.0 108.153 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.434 HG11 ' HA ' ' A' ' 9' ' ' ILE . 16.8 m -129.75 158.53 42.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.698 0.285 . . . . 10.0 111.035 -178.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.504 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -95.92 124.85 40.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.001 0.429 . . . . 10.0 110.507 179.098 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -64.52 112.46 3.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.912 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.442 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 57.16 30.85 19.02 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.75 0.656 . . . . 10.0 110.579 -178.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.2 t70 63.02 30.22 16.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 114.708 -1.133 . . . . 10.0 111.096 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.17 -83.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.03 -0.419 . . . . 10.0 111.347 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -96.7 125.12 48.05 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.683 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.504 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.1 Cg_endo -77.93 132.7 11.93 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.726 2.284 . . . . 10.0 111.489 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -151.27 169.12 22.71 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -94.38 123.9 38.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.631 0.253 . . . . 10.0 110.406 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.415 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -137.27 129.96 30.16 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.8 tt -107.6 123.02 62.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.199 0.523 . . . . 10.0 109.896 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.527 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.1 mtt85 -145.23 179.44 7.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.343 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -124.3 145.55 49.33 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.953 179.426 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.427 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 44.5 m95 -117.52 170.85 8.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.07 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -69.98 158.22 87.84 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.76 -34.95 92.53 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.605 2.204 . . . . 10.0 112.541 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -91.21 -0.52 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.596 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.2 30.17 19.14 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.786 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -84.46 -33.76 23.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.949 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -136.42 174.68 10.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.537 0.685 . . . . 10.0 111.819 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.463 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -141.27 173.25 11.66 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.702 -177.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.693 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.58 -157.36 7.25 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.605 -0.807 . . . . 10.0 112.412 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mttm -96.14 151.01 19.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.496 -0.414 . . . . 10.0 111.934 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.26 -121.16 1.25 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.5 tt -152.75 141.79 14.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.407 0.603 . . . . 10.0 111.229 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.9 140.82 38.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.707 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.8 mt -121.15 135.22 55.2 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.398 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 m -76.46 164.31 26.1 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.907 -0.405 . . . . 10.0 109.907 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -58.97 -46.98 86.75 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.98 -44.75 94.29 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.136 0.493 . . . . 10.0 110.315 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.435 ' HB3' HD12 ' B' ' 16' ' ' LEU . 80.4 mt-10 -61.4 -52.05 66.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.746 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.621 ' CE2' HD12 ' A' ' 66' ' ' LEU . 28.0 t80 -56.77 -44.29 81.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.311 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.3 -47.73 89.64 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.344 -0.455 . . . . 10.0 112.72 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 92.9 t -68.45 -43.89 83.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.4 tp -56.35 -49.52 74.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.792 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.621 HD12 ' CE2' ' A' ' 62' ' ' PHE . 19.0 mt -64.27 -44.66 91.02 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 121.16 -0.216 . . . . 10.0 111.462 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.2 tttm -54.67 -50.3 68.54 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.477 0.486 . . . . 10.0 110.848 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.538 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 25.2 mm-40 -70.5 -48.76 54.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.425 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 47.8 mt -59.04 -44.2 91.76 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.06 -38.42 95.97 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.411 -0.9 . . . . 10.0 110.996 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -70.09 -25.25 63.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.35 -0.425 . . . . 10.0 110.941 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 29.5 mmmt -67.97 -28.84 67.79 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.039 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 28.7 mt -88.12 -7.8 56.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.876 0.37 . . . . 10.0 110.814 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.523 -0.751 . . . . 10.0 110.172 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 120.767 0.317 . . . . 10.0 110.5 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.48 155.93 19.52 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -60.69 -49.2 78.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 10.0 110.47 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -136.29 101.8 4.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.577 HD11 H5'' ' C' ' 15' ' ' ' DT' . 26.2 tp -77.74 139.45 39.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.091 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.7 tppt? -75.29 136.43 40.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.111 0.481 . . . . 10.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.462 ' HB3' ' H72' ' C' ' 14' ' ' ' DT' . 11.0 p90 -160.47 171.73 18.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.31 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.401 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 10.5 tp10 -153.27 130.34 11.09 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.39 116.97 24.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.114 0.483 . . . . 10.0 110.805 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -88.32 -44.54 15.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.554 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -166.94 130.41 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.98 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.83 141.14 40.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 56.4 mt -113.16 -73.64 0.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.492 -0.483 . . . . 10.0 112.056 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.44 HD13 ' CB ' ' A' ' 68' ' ' GLU . 17.0 mm -128.84 139.43 51.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.1 0.476 . . . . 10.0 112.032 -177.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.8 p -124.44 120.69 59.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . 0.435 HD12 ' HB3' ' A' ' 61' ' ' GLU . 29.0 mt -91.11 -81.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.875 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -179.16 -166.35 0.09 Allowed 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -113.03 140.23 48.01 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.882 0.372 . . . . 10.0 110.829 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -77.31 -174.63 3.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.177 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.18 -18.79 65.57 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.381 0.61 . . . . 10.0 110.599 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -90.37 -5.72 55.85 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.424 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.58 69.2 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 111.247 -0.741 . . . . 10.0 111.247 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.501 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -64.48 104.92 0.85 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.68 0.276 . . . . 10.0 111.373 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.7 tpp85 -83.12 101.34 11.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.448 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.459 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 92.4 mttt -84.29 116.81 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.2 0.524 . . . . 10.0 111.073 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -134.12 146.73 50.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.364 -0.835 . . . . 10.0 110.659 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.446 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 39.1 tp -116.63 111.25 19.6 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.2 159.27 42.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.086 0.469 . . . . 10.0 111.296 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -93.38 114.25 26.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 m -130.42 157.82 42.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.921 0.391 . . . . 10.0 111.036 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.509 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 0.1 OUTLIER -95.23 124.59 39.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.585 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.459 ' CH2' ' H72' ' C' ' 17' ' ' ' DT' . 7.2 m0 -64.17 110.91 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.01 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.0 m-80 58.84 30.03 19.56 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 123.859 0.724 . . . . 10.0 110.473 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.8 t70 64.84 28.02 12.84 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.676 -1.147 . . . . 10.0 111.034 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.15 -83.28 0.59 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.018 -0.426 . . . . 10.0 111.746 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.605 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 30.0 tt0 -96.03 122.48 58.14 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.658 -0.246 . . . . 10.0 111.509 -178.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.509 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.69 129.55 10.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.976 2.451 . . . . 10.0 111.866 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -148.13 169.79 19.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -94.99 122.53 37.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.404 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.409 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -136.48 131.79 34.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 10.4 tt -108.92 122.44 63.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.207 0.527 . . . . 10.0 110.02 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.48 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.3 mtt85 -144.89 -179.71 6.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.44 -177.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.603 ' OG1' ' H73' ' C' ' 12' ' ' ' DT' . 0.0 OUTLIER -125.25 145.91 49.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.066 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 45.9 m95 -117.84 171.25 8.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.182 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.3 m -70.34 157.93 88.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.9 -0.407 . . . . 10.0 109.9 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -56.07 -32.05 85.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.601 2.201 . . . . 10.0 112.728 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.94 -3.55 51.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.099 0.476 . . . . 10.0 110.263 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 31.82 12.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.973 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -86.34 -30.86 21.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.032 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -137.91 174.41 10.6 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.401 0.62 . . . . 10.0 111.893 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.461 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -141.38 173.07 11.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.883 -1.053 . . . . 10.0 110.324 -177.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.692 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.18 -157.24 7.39 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.226 179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.42 147.13 26.7 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.033 -0.686 . . . . 10.0 111.967 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.98 -119.48 1.64 Allowed Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 110.724 -0.95 . . . . 10.0 110.724 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.5 tt -152.84 143.23 15.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 117.308 0.554 . . . . 10.0 111.005 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.46 140.46 38.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.85 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 48.2 mt -121.27 135.0 55.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.497 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.42 164.44 25.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.15 -0.477 . . . . 10.0 109.866 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -60.32 -44.86 95.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.43 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.488 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.1 pt-20 -63.35 -41.52 98.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.117 0.484 . . . . 10.0 110.637 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.481 ' CD ' ' HZ2' ' A' ' 25' ' ' LYS . 79.1 mt-10 -64.07 -50.54 67.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.246 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.465 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -59.22 -41.41 88.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.406 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.23 -50.89 62.99 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.088 -0.577 . . . . 10.0 112.334 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.488 HG23 ' O ' ' B' ' 60' ' ' GLU . 47.6 t -66.12 -45.83 89.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.058 0.456 . . . . 10.0 110.413 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.5 tp -55.3 -49.72 71.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.629 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 76.9 mt -61.77 -47.47 85.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.943 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -54.4 -52.4 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.588 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 7.5 mm-40 -68.82 -50.08 53.11 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.551 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.468 ' HB3' HD23 ' A' ' 66' ' ' LEU . 46.9 mt -60.09 -44.45 94.78 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.674 0.25 . . . . 10.0 111.674 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.07 -35.76 91.93 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.306 -0.718 . . . . 10.0 111.306 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -75.04 -25.19 58.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.87 0.367 . . . . 10.0 110.756 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 23.5 mmmt -64.9 -30.82 71.84 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.179 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 26.7 mt -89.29 0.42 56.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.186 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.691 -0.671 . . . . 10.0 109.358 179.158 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.417 ' H71' ' O ' ' A' ' 20' ' ' ALA . . . . . . . . 0 O5'--C5' 1.428 -0.766 0 C3'-C2'-C1' 101.668 -0.737 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C3'-C2'-C1' 101.539 -0.829 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.926 0 O4'-C1'-C2' 104.134 -1.787 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.747 ' H73' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.521 -0.701 0 O4'-C4'-C3' 103.599 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 O4'-C4'-C3' 103.552 -2.048 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.793 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.915 0 C5'-C4'-O4' 112.981 2.238 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 C3'-C2'-C1' 101.327 -0.98 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C3'-C2'-C1' 101.399 -0.93 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.603 ' H73' ' OG1' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 C3'-C2'-C1' 101.857 -0.602 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.406 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 O4'-C1'-C2' 104.393 -1.552 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.692 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C4'-C3' 103.638 -1.962 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.577 H5'' HD11 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C4'-C3' 103.736 -1.864 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.825 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.882 0 C5'-C4'-O4' 112.953 2.22 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.605 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 C3'-C2'-C1' 100.978 -1.23 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.427 ' H1 ' ' P ' ' C' ' 5' ' ' ' DT' . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 110.035 -0.358 . . . . 10.0 110.035 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.45 165.12 11.99 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.402 ' OD1' ' HG2' ' A' ' 4' ' ' LYS . 13.3 t70 -67.34 -58.71 4.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.156 0.503 . . . . 10.0 110.152 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.402 ' HG2' ' OD1' ' A' ' 3' ' ' ASP . 37.3 mmtm -132.79 104.67 6.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.757 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.609 ' HB3' ' H73' ' C' ' 4' ' ' ' DT' . 32.5 tp -76.39 141.18 41.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.774 0.321 . . . . 10.0 110.636 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -70.99 130.82 42.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.436 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.7 p90 -157.03 160.84 39.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.767 0.318 . . . . 10.0 110.934 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.464 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.7 tp10 -147.26 126.28 12.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.568 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.2 mt -82.69 106.12 13.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.15 0.5 . . . . 10.0 110.237 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.4 mm -76.49 -41.94 35.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.766 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -166.84 126.91 1.53 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.862 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -75.5 143.12 42.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 77.0 mt -110.01 -75.87 0.62 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.352 -0.539 . . . . 10.0 111.794 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.402 HD11 ' HB3' ' B' ' 68' ' ' GLU . 29.9 mm -128.49 137.34 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.53 . . . . 10.0 112.006 -177.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -119.83 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 177.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.0 mt -92.28 -80.92 0.35 Allowed 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.568 -0.453 . . . . 10.0 111.862 -178.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.84 -168.72 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.525 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -110.34 147.76 33.29 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -83.27 -168.83 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.538 ' O ' ' H71' ' C' ' 1' ' ' ' DT' . . . -67.77 -21.45 65.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.548 0.69 . . . . 10.0 110.317 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -91.5 1.06 57.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.95 -1.023 . . . . 10.0 110.718 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.74 4.77 88.68 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.58 -0.819 . . . . 10.0 111.395 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.525 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.24 103.28 0.37 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.89 0.376 . . . . 10.0 110.994 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 43' ' ' THR . 11.3 tpp85 -83.8 100.69 11.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.571 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.471 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 93.0 mttt -83.4 115.12 21.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.066 0.46 . . . . 10.0 110.828 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -131.4 143.54 50.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.47 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.515 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 40.0 tp -112.43 108.29 17.39 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.157 -1.053 . . . . 10.0 108.157 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -131.54 160.64 34.66 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 10.0 111.213 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -97.11 113.73 25.33 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.501 -0.925 . . . . 10.0 108.501 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.5 m -127.46 157.0 39.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 120.928 0.394 . . . . 10.0 110.767 -179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.501 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -95.95 125.81 40.76 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.176 178.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -64.62 110.21 2.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.959 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 60.66 27.53 17.25 Favored 'General case' 0 C--O 1.235 0.294 0 O-C-N 124.061 0.851 . . . . 10.0 110.624 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.6 t70 68.41 23.63 7.47 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.91 -1.041 . . . . 10.0 110.709 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.99 -84.67 0.54 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.102 -0.373 . . . . 10.0 111.666 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -91.63 123.27 64.05 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.501 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 62.8 Cg_endo -80.79 124.13 4.97 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.766 2.311 . . . . 10.0 111.808 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.407 ' HG2' ' H ' ' A' ' 39' ' ' TYR . 20.0 ttmm -143.08 170.03 16.47 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.407 ' H ' ' HG2' ' A' ' 38' ' ' LYS . 5.1 m-85 -96.1 126.57 41.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.684 0.278 . . . . 10.0 110.466 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.427 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -140.4 130.06 24.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.411 HD13 HG23 ' A' ' 41' ' ' ILE . 11.5 tt -106.55 124.32 61.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.354 0.597 . . . . 10.0 110.019 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.483 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.7 mtt85 -144.66 176.75 9.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.214 -177.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -123.63 142.11 51.36 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.796 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -117.58 170.66 8.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.932 -0.576 . . . . 10.0 109.616 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.11 159.08 73.59 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -57.81 -31.63 92.84 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.237 1.958 . . . . 10.0 111.773 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -91.57 -1.94 57.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.412 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 60.0 31.41 20.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.804 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -83.8 -33.14 25.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.165 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -135.74 174.88 10.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.366 0.603 . . . . 10.0 111.558 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.424 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -139.33 167.72 21.44 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.818 -1.083 . . . . 10.0 110.769 -177.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.679 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -135.11 -162.4 9.73 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.16 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -95.59 151.01 19.71 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.245 -0.562 . . . . 10.0 111.797 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.13 -125.43 1.61 Allowed Glycine 0 C--N 1.331 0.262 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.365 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.0 143.43 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.518 0.659 . . . . 10.0 111.259 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.92 140.06 39.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.572 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.4 mt -119.78 134.22 55.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.27 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.5 m -79.17 169.55 17.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.325 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.44 -49.8 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.707 0.262 . . . . 10.0 111.707 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -60.98 -43.47 98.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.548 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -61.03 -50.77 71.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.586 -0.733 . . . . 10.0 110.441 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.709 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.3 t80 -56.46 -45.84 80.66 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.239 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.89 -51.47 58.4 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.296 -0.478 . . . . 10.0 112.901 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.2 t -64.96 -42.69 95.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 10.0 110.664 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.62 -51.83 67.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.807 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.709 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -62.84 -45.47 92.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.47 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -52.65 -51.37 60.42 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.208 0.528 . . . . 10.0 111.246 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 9.6 mm-40 -71.41 -47.49 55.66 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.809 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HB3' HD23 ' B' ' 66' ' ' LEU . 48.4 mt -58.4 -44.46 88.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.574 0.226 . . . . 10.0 111.604 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.9 -40.41 99.24 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.577 -0.82 . . . . 10.0 111.143 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -68.53 -26.54 65.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.326 . . . . 10.0 110.728 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 68.3 mmtt -69.66 -27.04 64.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.022 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 35.7 mt -82.37 -25.46 33.78 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.073 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.618 -0.706 . . . . 10.0 110.465 -179.713 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.492 ' H2 ' ' P ' ' C' ' 15' ' ' ' DT' . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.331 . . . . 10.0 110.223 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.36 171.33 8.64 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.426 ' OD1' ' HG2' ' B' ' 4' ' ' LYS . 13.1 t70 -74.22 -56.6 4.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.03 0.443 . . . . 10.0 110.059 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.426 ' HG2' ' OD1' ' B' ' 3' ' ' ASP . 41.9 mmtm -134.08 101.65 5.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.76 -0.654 . . . . 10.0 109.372 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.614 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 37.1 tp -74.56 137.79 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.151 -0.314 . . . . 10.0 110.151 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -70.33 128.56 36.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.785 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -153.5 163.35 40.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.392 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.455 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 11.5 tp10 -150.16 122.9 8.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . 0.408 ' HA ' HG11 ' B' ' 30' ' ' VAL . 56.8 mt -79.07 109.9 14.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.144 0.497 . . . . 10.0 110.555 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.9 mm -79.13 -41.75 23.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.616 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -166.61 125.47 1.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.49 139.41 42.19 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 50.0 mt -108.46 -73.78 0.68 Allowed 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.385 -0.526 . . . . 10.0 112.294 -177.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.464 HD13 ' CB ' ' A' ' 68' ' ' GLU . 14.5 mm -128.01 132.22 68.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -177.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.8 p -115.77 122.37 69.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 177.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.1 mt -93.51 -80.83 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.754 -0.379 . . . . 10.0 111.84 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.8 m 178.94 -169.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.473 -0.565 . . . . 10.0 109.473 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.27 148.07 30.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.582 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -84.28 -171.92 3.88 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -18.69 65.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.383 0.611 . . . . 10.0 110.699 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . 0.417 ' HG2' ' C2 ' ' C' ' 11' ' ' ' DT' . 20.7 mttt -92.61 -3.32 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.606 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.82 4.13 76.03 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.418 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.508 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.2 m0 -62.06 104.01 0.43 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.747 0.308 . . . . 10.0 111.02 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.497 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.5 tpp85 -84.45 100.75 11.53 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 179.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.464 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 92.4 mttt -82.25 116.24 21.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.016 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -132.56 141.3 48.65 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.744 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.452 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 40.8 tp -110.79 108.11 17.84 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -131.78 159.14 39.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.936 0.398 . . . . 10.0 111.385 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -94.8 113.58 25.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.408 HG11 ' HA ' ' B' ' 9' ' ' ILE . 14.7 m -126.88 157.79 37.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.884 0.373 . . . . 10.0 110.773 -179.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.1 p -97.26 125.5 41.86 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.32 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -64.53 110.4 2.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.932 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 59.24 30.09 19.77 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.504 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 34.0 t70 66.48 20.85 10.87 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.512 -1.222 . . . . 10.0 111.142 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -87.4 0.45 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.803 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.617 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 30.8 tt0 -89.87 122.4 67.96 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-O 120.658 0.266 . . . . 10.0 111.64 -178.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 59.5 Cg_endo -79.47 125.24 6.18 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.86 2.374 . . . . 10.0 111.954 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.427 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 20.1 ttmm -144.12 169.88 17.01 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . 0.427 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 3.2 m-85 -97.24 125.45 41.81 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.436 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.77 129.32 24.33 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 10.4 tt -105.12 124.08 59.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.249 0.547 . . . . 10.0 110.044 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.49 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 2.7 mtt85 -144.29 175.62 9.95 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.346 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -122.21 142.0 50.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.048 179.698 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -117.73 169.75 9.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.452 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 158.83 73.67 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -56.08 -34.55 93.02 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.153 1.902 . . . . 10.0 111.602 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -88.38 -4.19 58.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.555 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.72 34.93 19.81 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.349 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.68 -34.82 21.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.723 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -134.04 174.34 10.59 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.268 0.556 . . . . 10.0 111.568 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.423 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -137.89 167.79 21.02 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.607 -1.179 . . . . 10.0 110.4 -178.196 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.685 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -135.0 -161.46 9.42 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.955 -0.64 . . . . 10.0 112.387 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -96.75 148.28 23.05 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.432 -0.452 . . . . 10.0 111.57 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.86 -124.5 1.81 Allowed Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 111.323 -0.711 . . . . 10.0 111.323 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -148.21 142.23 19.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 117.499 0.65 . . . . 10.0 111.129 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.88 139.01 39.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.918 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 133.16 56.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.477 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.7 m -78.26 170.6 16.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.25 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.32 -52.58 64.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.294 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.561 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.9 pt-20 -58.97 -42.36 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.098 0.475 . . . . 10.0 110.641 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -62.4 -50.19 72.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.667 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.533 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.2 t80 -57.65 -43.19 84.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.586 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.69 -51.77 56.58 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.36 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 60' ' ' GLU . 35.5 t -62.57 -45.84 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 10.0 110.422 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.6 tp -56.43 -53.29 59.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.373 -0.83 . . . . 10.0 110.721 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 32.4 mt -59.9 -48.8 80.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.249 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -52.2 -53.65 40.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.757 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 8.9 mm-40 -69.92 -48.53 58.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.973 -178.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.467 ' HB3' HD23 ' A' ' 66' ' ' LEU . 47.6 mt -59.12 -42.95 91.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.551 0.215 . . . . 10.0 111.418 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.12 -38.97 97.01 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.599 -0.81 . . . . 10.0 111.294 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . 0.442 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.9 t-20 -71.05 -27.46 63.66 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 10.0 110.915 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.0 mmtt -66.99 -26.03 66.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.367 -0.379 . . . . 10.0 111.553 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 23.1 mt -89.62 -13.6 36.75 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.546 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.442 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 42.9 mt-10 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.632 -0.699 . . . . 10.0 110.3 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.538 ' H71' ' O ' ' A' ' 20' ' ' ALA . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 C3'-C2'-C1' 101.655 -0.747 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 101.494 -0.862 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.405 -1.131 0 O4'-C1'-C2' 104.127 -1.794 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.679 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 C4'--C3' 1.52 -0.844 0 O4'-C4'-C3' 103.481 -2.119 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.476 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C4'-C3' 103.656 -1.944 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.756 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.533 0.829 0 C5'-C4'-O4' 112.88 2.175 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.831 0 C3'-C2'-C1' 101.514 -0.847 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . 0.417 ' C2 ' ' HG2' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 C3'-C2'-C1' 101.624 -0.768 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.808 0 C3'-C2'-C1' 101.865 -0.596 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.938 0 O4'-C1'-C2' 104.357 -1.585 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.685 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 O4'-C4'-C3' 103.517 -2.083 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.492 ' P ' ' H2 ' ' B' ' 1' ' ' MET . . . . . . . . 0 O5'--C5' 1.426 -0.885 0 O4'-C4'-C3' 103.864 -1.736 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.75 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.937 0 C5'-C4'-O4' 112.964 2.228 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.617 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 C3'-C2'-C1' 101.08 -1.157 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.7 mmm . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 120.916 0.389 . . . . 10.0 110.304 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.47 179.91 4.13 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.061 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -82.8 -60.73 2.08 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -131.13 94.64 3.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.068 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.61 HD21 ' H71' ' C' ' 4' ' ' ' DT' . 27.7 tp -71.16 139.46 50.22 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.801 0.334 . . . . 10.0 110.272 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -71.75 137.46 47.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.957 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.6 p90 -161.44 172.15 16.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.934 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -155.44 138.13 15.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.8 mt -85.47 113.64 24.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.923 0.392 . . . . 10.0 110.335 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.07 -44.05 17.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.964 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -167.78 128.59 1.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.331 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -79.62 136.5 36.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.498 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 58.3 mt -106.99 -75.08 0.64 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.386 0.514 . . . . 10.0 112.386 -178.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.421 HD11 ' HB3' ' B' ' 68' ' ' GLU . 31.8 mm -127.07 140.93 47.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 112.596 0.591 . . . . 10.0 112.596 -177.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.1 p -121.2 123.22 69.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 177.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 31.1 mt -92.25 -81.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.542 -0.463 . . . . 10.0 111.572 -178.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -179.98 -174.8 0.28 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 122.748 0.419 . . . . 10.0 110.006 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.58 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 26.5 mp0 -111.12 156.81 20.81 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -102.99 -169.94 1.72 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.003 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.9 -23.43 67.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.391 0.615 . . . . 10.0 110.515 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -87.82 -4.66 58.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.511 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.03 3.56 87.61 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.759 -0.655 . . . . 10.0 112.063 -178.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.58 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 42.0 m0 -55.24 102.54 0.07 Allowed 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.373 0.269 . . . . 10.0 111.649 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.548 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.4 tpp85 -80.22 100.3 8.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.405 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 81.0 mttt -82.35 113.2 19.97 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.89 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -139.26 153.9 47.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.35 0.595 . . . . 10.0 111.743 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.53 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 38.5 tp -123.07 107.67 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.933 -1.03 . . . . 10.0 108.26 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -133.94 166.11 23.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.927 0.394 . . . . 10.0 110.88 -177.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.4 ttp180 -105.58 114.9 29.35 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.184 -0.673 . . . . 10.0 109.184 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 m -126.15 162.12 30.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.498 -179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 36' ' ' GLU . 1.0 OUTLIER -99.29 123.12 43.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.948 0.404 . . . . 10.0 110.515 179.136 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 14.7 m0 -64.73 112.86 3.42 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.837 -0.619 . . . . 10.0 109.619 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 59.7 26.1 15.16 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.806 0.692 . . . . 10.0 110.207 -178.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t0 63.52 28.48 15.29 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.614 -1.176 . . . . 10.0 110.96 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.69 -74.66 0.61 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.068 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 31' ' ' SER . 45.7 tt0 -91.01 118.09 68.34 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.526 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 70.0 Cg_endo -82.58 120.79 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.601 2.201 . . . . 10.0 110.667 177.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -150.06 163.07 39.11 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.796 -0.362 . . . . 10.0 110.771 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -83.47 139.48 32.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.538 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -151.05 130.61 13.01 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.411 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -108.83 123.7 64.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.238 0.542 . . . . 10.0 110.111 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.456 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.1 mtt85 -149.1 174.4 12.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.222 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.548 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 2.9 p -123.25 135.52 54.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 49.1 m0 -116.8 176.62 5.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.592 0.234 . . . . 10.0 110.693 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -66.86 153.64 93.71 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.406 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.41 -37.97 77.68 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.387 2.058 . . . . 10.0 111.561 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -83.76 -4.08 58.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.221 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 62.35 24.93 14.87 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.468 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -76.52 -31.73 57.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.973 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -140.07 174.13 10.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.33 0.586 . . . . 10.0 111.475 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.31 171.22 14.75 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.432 -178.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.538 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -138.15 -170.0 11.75 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.497 -0.859 . . . . 10.0 112.285 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -98.38 145.38 26.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.461 -0.435 . . . . 10.0 111.894 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.83 -111.87 0.85 Allowed Glycine 0 N--CA 1.453 -0.2 0 N-CA-C 110.952 -0.859 . . . . 10.0 110.952 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 tt -155.93 141.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 117.306 0.553 . . . . 10.0 110.803 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.43 ' HB ' ' H71' ' C' ' 7' ' ' ' DT' . 3.2 m -98.44 141.67 31.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.139 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.3 mt -119.62 122.47 41.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.098 0.475 . . . . 10.0 110.543 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -80.93 168.34 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.578 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.13 -38.37 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.577 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.455 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -59.41 -47.84 83.92 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.388 178.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.455 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 29.5 mt-10 -66.96 -56.7 9.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.975 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.68 ' CE2' HD11 ' A' ' 66' ' ' LEU . 9.5 t80 -50.35 -45.84 55.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.437 -0.801 . . . . 10.0 111.956 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.1 -56.48 25.02 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.195 -0.526 . . . . 10.0 113.126 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.17 -43.53 91.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 10.0 111.14 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.438 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.0 tp -55.58 -51.61 66.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.973 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.68 HD11 ' CE2' ' A' ' 62' ' ' PHE . 20.5 mt -62.83 -45.47 92.45 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 121.002 -0.279 . . . . 10.0 111.121 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 ttpp -53.82 -52.63 59.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.89 -0.595 . . . . 10.0 111.005 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.562 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 15.8 mm-40 -69.69 -49.11 56.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.905 -178.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.9 mt -58.32 -44.78 88.81 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.624 0.25 . . . . 10.0 111.404 -179.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.24 -35.66 92.25 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.405 -0.902 . . . . 10.0 111.348 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -74.57 -18.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.867 0.365 . . . . 10.0 110.81 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.562 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 66.2 mmtt -75.19 -26.2 58.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.057 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 28.1 mt -90.1 -3.31 57.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.938 0.399 . . . . 10.0 110.565 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 118.481 -0.771 . . . . 10.0 110.336 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 90.3 mmm . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 120.878 0.37 . . . . 10.0 110.424 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.54 178.43 4.56 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.451 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -82.06 -58.25 3.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -131.79 94.04 3.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.226 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.548 HD21 ' H72' ' C' ' 14' ' ' ' DT' . 27.4 tp -70.63 139.08 51.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.253 179.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -73.02 134.96 44.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 10.0 110.893 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.583 ' CD1' ' H71' ' C' ' 14' ' ' ' DT' . 11.3 p90 -158.78 170.52 21.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.882 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.484 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.5 tp10 -153.08 134.35 14.22 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 52.2 mt -82.73 110.48 17.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.966 0.412 . . . . 10.0 110.413 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.4 mm -79.8 -48.61 20.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.635 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -164.96 129.46 2.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.229 -179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.93 144.51 36.78 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 57.8 mt -115.08 -70.75 0.78 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.231 -0.588 . . . . 10.0 112.433 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.429 HD12 ' HB3' ' A' ' 68' ' ' GLU . 15.3 mm -128.45 142.54 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.926 0.393 . . . . 10.0 111.847 -176.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.51 118.54 52.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.6 mt -88.23 -80.94 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -177.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 178.46 -172.24 0.13 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.591 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 24.0 mp0 -115.15 151.78 33.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.312 -0.403 . . . . 10.0 109.999 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -96.82 -167.88 1.62 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . 0.511 ' O ' ' H72' ' C' ' 11' ' ' ' DT' . . . -68.61 -15.17 63.44 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.345 0.593 . . . . 10.0 110.601 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -94.41 -2.01 52.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.957 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.31 4.31 90.23 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.275 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.591 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.6 m0 -56.94 102.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.5 tpp85 -80.15 100.6 8.33 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -82.25 113.76 20.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.898 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -139.83 155.1 47.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.438 0.637 . . . . 10.0 111.747 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.514 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 37.3 tp -124.24 107.91 11.7 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.191 -1.04 . . . . 10.0 108.191 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -133.9 164.42 27.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.918 0.39 . . . . 10.0 110.927 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.1 ttp180 -104.13 114.3 28.44 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.4 m -125.25 162.1 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.748 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.484 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -99.79 121.81 41.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.505 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.598 ' CH2' ' H73' ' C' ' 17' ' ' ' DT' . 17.1 m0 -64.2 112.88 3.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.763 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 59.75 26.18 15.28 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.014 -178.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.0 t0 61.3 33.4 19.0 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 114.517 -1.22 . . . . 10.0 110.491 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.92 -70.05 0.81 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.064 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' B' ' 31' ' ' SER . 44.2 tt0 -94.92 117.58 66.83 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.601 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -81.64 120.16 3.47 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.372 2.048 . . . . 10.0 110.708 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 11.0 ttpt -150.24 163.23 38.81 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.804 -0.358 . . . . 10.0 110.708 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.88 138.51 32.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.347 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -150.04 130.5 13.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 9.2 tt -108.53 123.13 64.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.388 0.613 . . . . 10.0 110.14 -179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.551 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.9 mtt85 -149.03 175.47 11.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.574 -178.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.546 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 4.5 p -124.31 135.4 53.33 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -117.02 175.1 5.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.424 -0.213 . . . . 10.0 110.424 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.7 m -65.49 153.85 89.32 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.452 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.08 -34.97 89.07 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.424 2.083 . . . . 10.0 111.319 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.57 -4.75 59.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.049 -0.978 . . . . 10.0 110.23 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 61.98 23.81 14.08 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.783 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -76.7 -29.7 56.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -141.48 174.53 10.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.557 0.694 . . . . 10.0 111.953 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.15 171.8 13.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.32 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.485 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -139.72 -170.64 12.01 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.238 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.9 mttp -97.57 141.61 30.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.256 0.55 . . . . 10.0 112.426 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -138.57 -119.32 1.72 Allowed Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.386 -1.086 . . . . 10.0 110.386 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -149.43 143.14 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 117.27 0.535 . . . . 10.0 110.674 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 4.0 m -97.81 139.57 33.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.524 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -117.75 119.29 34.46 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.967 0.413 . . . . 10.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.7 166.93 21.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.314 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.0 -35.17 74.46 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.874 0.368 . . . . 10.0 110.922 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.422 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.9 pt-20 -61.75 -46.07 91.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.062 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.422 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 31.3 mt-10 -68.34 -57.21 6.27 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.863 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.493 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.5 t80 -52.15 -42.28 63.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.463 -0.789 . . . . 10.0 111.478 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.99 -55.52 30.43 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.875 -0.678 . . . . 10.0 112.954 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 19.1 t -68.66 -42.36 83.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.937 0.399 . . . . 10.0 110.865 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.0 tp -56.59 -50.93 70.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.021 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 60.1 mt -60.62 -50.69 72.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.726 0.298 . . . . 10.0 110.606 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 24.8 tttm -50.84 -53.04 35.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.8 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.543 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 30.6 mm-40 -69.4 -52.45 26.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.282 -178.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.488 ' HB3' HD23 ' A' ' 66' ' ' LEU . 62.4 mt -58.87 -43.13 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.91 -38.23 96.22 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.47 -0.872 . . . . 10.0 111.142 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . 0.404 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.4 t-20 -73.51 -20.06 60.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.504 -0.348 . . . . 10.0 111.359 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.8 mmtt -72.64 -27.51 62.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.658 0.266 . . . . 10.0 110.95 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.88 0.46 57.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.984 0.421 . . . . 10.0 111.019 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.404 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.9 mt-10 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.789 -0.624 . . . . 10.0 109.892 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 101.73 -0.693 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.546 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 101.315 -0.989 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.546 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.889 0 O4'-C1'-C2' 104.053 -1.861 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.61 ' H71' HD21 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.855 0 O4'-C4'-C3' 103.567 -2.033 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.456 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 O4'-C4'-C3' 103.521 -2.079 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.745 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.787 0 C5'-C4'-O4' 113.084 2.302 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.43 ' H71' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.423 -1.04 0 C3'-C2'-C1' 101.179 -1.086 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . 0.511 ' H72' ' O ' ' B' ' 20' ' ' ALA . . . . . . . . 0 O5'--C5' 1.427 -0.797 0 C3'-C2'-C1' 101.394 -0.933 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.514 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.901 0 C3'-C2'-C1' 101.913 -0.562 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.514 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.83 0 O4'-C1'-C2' 104.36 -1.582 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.627 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.519 -0.9 0 O4'-C4'-C3' 103.599 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.551 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.976 0 O4'-C4'-C3' 103.714 -1.886 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.745 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.831 0 C5'-C4'-O4' 113.154 2.346 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.598 ' H73' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 C3'-C2'-C1' 100.971 -1.235 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.756 0.312 . . . . 10.0 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.46 160.23 17.98 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -66.96 -53.4 32.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.236 -0.653 . . . . 10.0 109.236 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -139.98 95.23 2.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.195 -0.911 . . . . 10.0 109.697 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.691 HD11 H5'' ' C' ' 5' ' ' ' DT' . 23.5 tp -64.22 145.77 55.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.852 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.455 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.1 tppt? -79.25 136.48 37.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.47 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -164.32 163.53 22.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.189 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.446 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.8 tp10 -145.4 126.09 14.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.438 ' HA ' HG12 ' A' ' 30' ' ' VAL . 84.6 mt -73.83 110.77 8.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.002 0.429 . . . . 10.0 110.147 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mm -80.68 -48.89 19.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -162.96 126.65 2.88 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.042 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -78.39 144.31 36.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 68.7 mt -112.44 -75.46 0.61 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.565 -0.454 . . . . 10.0 111.625 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.0 mm -128.87 140.35 49.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.304 0.573 . . . . 10.0 112.49 -177.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.59 120.45 60.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 107.85 -1.167 . . . . 10.0 107.85 177.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.446 HD22 ' HB ' ' B' ' 64' ' ' VAL . 32.5 mt -89.72 -81.68 0.28 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.567 -0.453 . . . . 10.0 112.124 -177.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.2 m -174.51 -168.39 0.37 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -107.44 136.57 47.01 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.827 -0.435 . . . . 10.0 109.827 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -74.43 -173.83 1.85 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.793 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.06 68.45 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.614 0.721 . . . . 10.0 110.574 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -88.66 -1.07 57.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.811 -1.086 . . . . 10.0 110.91 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.36 1.62 81.01 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.125 -0.79 . . . . 10.0 111.125 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -59.06 106.05 0.38 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.838 0.351 . . . . 10.0 111.318 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.4 tpp85 -84.53 99.74 10.93 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.504 178.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.413 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 93.3 mttt -82.91 118.29 23.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.425 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -133.56 149.79 51.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.986 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 40.3 tp -117.76 108.11 14.97 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.612 -0.884 . . . . 10.0 108.612 178.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -135.63 160.97 36.85 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.791 0.329 . . . . 10.0 110.451 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 ttp180 -102.19 115.0 29.63 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.438 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.2 m -125.26 161.85 28.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.691 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.446 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.4 p -93.39 124.52 37.44 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -63.66 108.28 1.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 61.8 m-80 59.28 30.36 20.08 Favored 'General case' 0 CA--C 1.522 -0.108 0 O-C-N 123.869 0.73 . . . . 10.0 109.703 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 44.1 t0 62.91 26.69 15.67 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.365 -1.289 . . . . 10.0 111.09 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.26 -71.2 0.76 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.128 -0.357 . . . . 10.0 111.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -94.16 114.79 64.13 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.853 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 53.5 Cg_endo -78.27 119.9 4.74 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.164 1.909 . . . . 10.0 110.282 177.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -150.03 166.23 30.33 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.889 -0.324 . . . . 10.0 110.489 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -87.01 132.16 33.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 10.0 110.867 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.415 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -144.8 132.96 21.57 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.1 tt -109.88 121.83 63.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.356 0.598 . . . . 10.0 109.824 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.48 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtt85 -144.74 179.44 7.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.281 -177.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.558 ' HG1' ' H72' ' C' ' 2' ' ' ' DT' . 0.1 OUTLIER -128.05 146.01 50.81 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.197 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -117.23 178.16 4.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.938 -0.573 . . . . 10.0 109.783 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 p -80.36 161.41 64.97 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -57.63 -29.78 86.46 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.368 2.045 . . . . 10.0 112.612 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -100.5 0.16 39.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.135 0.493 . . . . 10.0 110.323 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 59.14 34.19 23.16 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.219 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.14 -37.22 22.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.102 0.477 . . . . 10.0 110.327 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -139.35 174.38 10.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.912 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.422 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -150.55 173.04 14.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.758 -177.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.636 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -133.42 -162.08 9.99 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.779 -0.724 . . . . 10.0 112.212 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -90.08 162.5 15.29 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.361 -0.493 . . . . 10.0 112.243 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -152.78 -121.63 0.89 Allowed Glycine 0 C--N 1.33 0.229 0 CA-C-N 115.248 -0.887 . . . . 10.0 111.277 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.2 tt -153.66 143.17 14.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 117.48 0.64 . . . . 10.0 110.969 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.583 ' HB ' ' H71' ' C' ' 7' ' ' ' DT' . 0.7 OUTLIER -105.01 145.73 30.03 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.955 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -125.94 132.11 52.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.007 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.417 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 1.4 m -75.36 161.61 29.12 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -57.12 -46.23 82.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.559 -179.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.49 -46.13 91.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.944 0.402 . . . . 10.0 110.585 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.417 ' CD ' ' HG ' ' A' ' 58' ' ' SER . 84.4 mt-10 -59.52 -49.59 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.355 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.566 ' CE2' HD12 ' A' ' 66' ' ' LEU . 15.6 t80 -57.07 -43.84 82.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.22 -0.9 . . . . 10.0 111.356 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.43 -56.3 25.99 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.717 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.87 -41.28 88.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.912 0.387 . . . . 10.0 110.373 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 17.4 tp -58.2 -54.6 45.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.872 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.566 HD12 ' CE2' ' A' ' 62' ' ' PHE . 22.2 mt -62.44 -46.29 89.19 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.757 -0.201 . . . . 10.0 111.465 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 tttm -50.4 -49.98 53.03 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.603 0.564 . . . . 10.0 111.459 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.593 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 13.3 mm-40 -72.35 -48.67 40.11 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.414 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 84.1 mt -57.41 -44.98 85.04 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.05 98.75 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.686 -0.769 . . . . 10.0 111.372 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.466 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 13.1 t-20 -68.06 -28.31 67.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.955 0.407 . . . . 10.0 111.057 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.593 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.6 mmtt -67.41 -28.9 68.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.087 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.5 mt -89.68 -4.86 57.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.682 -0.236 . . . . 10.0 111.126 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.466 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 41.1 mt-10 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.42 -0.8 . . . . 10.0 110.722 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.865 0.364 . . . . 10.0 110.406 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.4 161.78 13.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.2 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.01 -51.81 29.3 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -139.98 94.51 2.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.212 -0.904 . . . . 10.0 109.313 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.597 HD13 H5'' ' C' ' 15' ' ' ' DT' . 25.3 tp -62.35 145.12 54.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.121 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -79.43 134.08 36.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.658 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.524 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 7.4 p90 -163.44 161.71 24.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.449 179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -142.38 130.22 21.7 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 65.5 mt -78.26 105.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.939 0.4 . . . . 10.0 110.802 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 40.8 mm -75.99 -47.42 32.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.619 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -164.04 127.33 2.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.08 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -79.67 141.72 36.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.5 mt -112.09 -72.98 0.69 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.381 -0.528 . . . . 10.0 112.354 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.438 HD12 HG23 ' B' ' 14' ' ' ILE . 18.6 mm -127.81 140.39 49.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.107 0.48 . . . . 10.0 112.074 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -125.26 115.47 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -84.94 -82.19 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.207 0.447 . . . . 10.0 112.207 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.0 m -177.42 -167.9 0.17 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -107.03 138.25 43.55 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -76.93 -172.67 2.4 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.868 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.87 -13.92 62.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.41 0.624 . . . . 10.0 111.417 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -101.14 2.27 40.02 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.885 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 2.22 85.2 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.269 -178.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 41.1 m0 -59.93 106.06 0.46 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.975 0.417 . . . . 10.0 111.484 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.1 tpp85 -84.57 100.03 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.646 178.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -82.53 118.73 23.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.908 0.385 . . . . 10.0 110.486 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -133.54 148.32 51.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.93 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.498 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 41.4 tp -118.03 107.74 14.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.412 -0.959 . . . . 10.0 108.412 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -135.99 162.5 32.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.893 0.377 . . . . 10.0 110.743 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -103.2 114.83 29.44 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.4 m -123.85 162.2 25.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.46 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.408 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.1 p -93.91 123.41 37.25 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.865 -0.421 . . . . 10.0 109.865 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.21 108.01 1.18 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.476 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.7 m-80 60.05 29.26 18.84 Favored 'General case' 0 CA--C 1.523 -0.082 0 O-C-N 123.707 0.629 . . . . 10.0 109.773 -177.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t0 61.27 34.57 18.56 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.7 -1.136 . . . . 10.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.09 -71.61 0.72 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.083 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.461 ' CD ' ' HZ3' ' B' ' 38' ' ' LYS . 46.4 tt0 -91.77 114.58 62.41 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.385 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.408 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 39.3 Cg_endo -80.64 118.7 3.54 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.773 1.649 . . . . 10.0 109.964 178.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.461 ' HZ3' ' CD ' ' B' ' 36' ' ' GLU . 16.8 ttpt -148.23 166.62 27.39 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 110.217 -0.29 . . . . 10.0 110.217 -177.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -87.56 132.79 33.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.583 -0.281 . . . . 10.0 110.666 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.42 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -145.57 132.07 19.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.99 -0.744 . . . . 10.0 108.99 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 9.3 tt -108.94 121.65 62.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.442 0.639 . . . . 10.0 109.915 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.42 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.2 mtt85 -144.11 179.88 6.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.307 -178.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -128.86 146.3 50.97 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.402 -179.762 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -117.56 176.66 5.07 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.941 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -77.64 161.15 72.94 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.211 -0.662 . . . . 10.0 109.211 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.41 -30.25 87.31 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.268 1.979 . . . . 10.0 112.16 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -97.14 -4.98 38.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.74 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 64.01 29.83 14.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.558 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -82.35 -37.31 25.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.111 0.481 . . . . 10.0 110.293 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -137.54 171.77 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.984 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.405 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -148.82 173.13 13.6 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.577 -178.068 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.683 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -132.86 -158.45 8.84 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.849 -0.691 . . . . 10.0 112.271 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -92.64 160.63 14.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.16 0.505 . . . . 10.0 112.307 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -152.31 -127.95 1.33 Allowed Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.654 -0.979 . . . . 10.0 110.654 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.5 tt -147.98 143.32 19.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 117.511 0.656 . . . . 10.0 111.24 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -103.67 145.02 30.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.685 -0.688 . . . . 10.0 111.132 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 81.5 mt -125.8 131.63 52.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.266 -0.424 . . . . 10.0 109.99 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -75.29 161.33 29.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.17 -47.0 82.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.702 0.287 . . . . 10.0 111.657 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.452 ' O ' HG21 ' B' ' 64' ' ' VAL . 12.1 pt-20 -62.17 -42.16 99.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.987 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -63.12 -48.72 77.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.868 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.516 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -59.29 -40.19 85.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.756 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.28 -56.06 27.3 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.176 -0.535 . . . . 10.0 112.625 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.452 HG21 ' O ' ' B' ' 60' ' ' GLU . 8.1 t -62.16 -41.69 92.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.001 0.429 . . . . 10.0 110.486 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.3 tp -58.03 -54.48 46.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.048 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 51.1 mt -61.31 -48.45 81.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.577 -0.283 . . . . 10.0 111.219 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -49.57 -52.71 28.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.844 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.642 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 8.0 mm-40 -71.31 -48.22 51.9 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.958 -178.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.42 ' HB3' HD23 ' A' ' 66' ' ' LEU . 60.5 mt -58.57 -45.24 89.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.71 -0.223 . . . . 10.0 111.56 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.64 96.24 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.685 -0.769 . . . . 10.0 111.358 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . 0.549 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.6 t-20 -70.9 -26.61 63.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.931 0.396 . . . . 10.0 111.149 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.3 mmtt -68.28 -27.21 66.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.272 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 22.5 mt -90.9 -2.35 57.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.974 -0.29 . . . . 10.0 111.446 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.549 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.4 mt-10 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.606 -0.711 . . . . 10.0 110.038 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.561 0 C3'-C2'-C1' 101.618 -0.773 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.558 ' H72' ' HG1' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.425 -0.938 0 C3'-C2'-C1' 101.343 -0.969 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.91 0 O4'-C1'-C2' 104.187 -1.739 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.636 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 O4'-C4'-C3' 103.644 -1.956 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.691 H5'' HD11 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 O4'-C4'-C3' 103.521 -2.079 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.81 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.434 1.069 0 C5'-C4'-O4' 113.166 2.354 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.583 ' H71' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.427 -0.803 0 C3'-C2'-C1' 101.172 -1.091 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 101.626 -0.767 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.488 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 101.793 -0.648 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.488 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.897 0 O4'-C1'-C2' 104.436 -1.513 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.693 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 O4'-C4'-C3' 103.507 -2.093 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.597 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 C4'-C3'-C2' 101.503 -1.697 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.813 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.863 0 C5'-C4'-O4' 113.032 2.27 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.953 0 C3'-C2'-C1' 100.954 -1.247 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.894 0.378 . . . . 10.0 110.572 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.78 161.83 16.47 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.85 -58.74 5.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.986 0.422 . . . . 10.0 110.291 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.12 93.48 3.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.004 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.529 HD23 ' H71' ' C' ' 4' ' ' ' DT' . 24.0 tp -64.78 141.16 58.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -74.25 132.39 42.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.451 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 9.0 p90 -156.77 166.19 34.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.958 179.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.425 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.7 tp10 -154.56 129.39 9.39 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -78.11 114.68 19.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.106 0.479 . . . . 10.0 110.147 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.7 mm -85.28 -41.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.171 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -169.42 127.73 0.97 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.685 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -75.28 143.94 42.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 85.2 mt -114.78 -73.7 0.64 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.349 -0.541 . . . . 10.0 111.626 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.404 HD11 ' O ' ' A' ' 13' ' ' LEU . 28.7 mm -129.19 143.85 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 10.0 112.315 -177.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.7 p -128.24 123.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 108.205 -1.035 . . . . 10.0 108.205 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.4 mt -91.49 -81.37 0.33 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.263 -0.575 . . . . 10.0 111.5 -178.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -177.27 -171.87 0.36 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -104.1 133.46 49.01 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -73.5 -173.72 1.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.684 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.86 -30.63 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.72 0.771 . . . . 10.0 110.31 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -83.64 -2.14 55.48 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.544 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.02 2.28 81.08 Favored Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.406 -0.902 . . . . 10.0 110.947 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 40.9 m0 -60.03 105.57 0.41 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.981 0.42 . . . . 10.0 111.191 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.488 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.3 tpp85 -82.77 100.11 10.08 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.492 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' HZ1' ' CD ' ' B' ' 61' ' ' GLU . 86.9 mttt -80.92 115.09 20.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.435 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -133.09 154.25 50.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.998 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 36.1 tp -125.42 107.96 11.18 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -134.9 156.72 48.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.804 0.335 . . . . 10.0 110.899 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -90.76 114.72 27.16 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.03 -0.73 . . . . 10.0 109.03 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.7 m -126.03 156.54 36.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.805 0.336 . . . . 10.0 110.763 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.48 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.8 p -94.45 122.94 37.54 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.933 0.397 . . . . 10.0 110.565 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -64.42 109.47 1.95 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.049 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.0 m-80 60.33 31.04 20.29 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.67 -0.696 . . . . 10.0 110.151 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.19 17.05 10.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.548 -1.205 . . . . 10.0 111.222 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.07 -97.79 0.28 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.446 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.78 124.48 85.04 Favored Pre-proline 0 C--O 1.234 0.247 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.48 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.9 Cg_endo -80.09 123.78 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.832 2.355 . . . . 10.0 111.456 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -142.27 167.23 22.59 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.738 -0.385 . . . . 10.0 110.169 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -92.36 128.74 38.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.127 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.439 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.7 t70 -141.69 130.45 22.89 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.422 ' HB ' HD12 ' A' ' 27' ' ' LEU . 10.4 tt -106.45 122.33 60.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 110.03 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.492 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.7 mtt85 -144.87 -178.35 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.105 -177.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -127.68 142.4 51.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.817 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -117.47 175.06 5.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 10.0 109.783 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.53 159.67 71.53 Favored Pre-proline 0 C--N 1.32 -0.703 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -59.58 -28.38 87.28 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.347 2.032 . . . . 10.0 111.981 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -93.43 -5.51 49.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.126 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.12 31.61 21.43 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.563 -179.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 50' ' ' LYS . 13.5 pt-20 -81.74 -40.0 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.531 -0.759 . . . . 10.0 110.927 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.409 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 44.8 mmtm -140.24 173.64 11.31 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.82 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.443 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -148.38 172.23 14.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.708 -177.755 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.693 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -130.51 -154.65 8.05 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.708 -0.758 . . . . 10.0 112.232 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -100.46 155.23 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.253 -0.557 . . . . 10.0 112.221 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.6 -120.27 1.23 Allowed Glycine 0 CA--C 1.518 0.246 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.921 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -150.52 142.66 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 117.564 0.682 . . . . 10.0 111.275 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.28 146.01 29.41 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.771 -0.65 . . . . 10.0 111.011 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.7 mt -131.55 127.18 36.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 m -80.26 171.61 14.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.699 0.285 . . . . 10.0 111.194 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -52.16 -59.43 4.38 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -59.52 -45.58 91.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.622 0.249 . . . . 10.0 111.641 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -59.86 -50.18 74.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 10.0 110.7 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.56 ' CE2' HD13 ' A' ' 66' ' ' LEU . 39.9 t80 -62.18 -41.68 98.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.397 -0.819 . . . . 10.0 111.215 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.77 57.22 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 116.069 -0.514 . . . . 10.0 112.913 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.43 -41.68 93.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.903 0.383 . . . . 10.0 110.226 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -57.31 -52.27 66.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.45 179.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.56 HD13 ' CE2' ' A' ' 62' ' ' PHE . 18.1 mt -62.38 -45.21 94.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.733 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -51.99 -50.13 61.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.172 -179.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.572 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 5.5 mm-40 -72.71 -46.31 54.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.664 -179.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 60.9 mt -58.34 -45.34 88.3 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.8 0.333 . . . . 10.0 111.575 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.38 -39.86 98.24 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 111.166 -0.774 . . . . 10.0 111.166 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.45 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 18.0 t-20 -67.22 -29.82 69.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.994 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.4 mmtt -68.12 -27.3 66.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.735 0.302 . . . . 10.0 110.731 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 25.5 mt -89.47 -8.45 52.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.039 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.45 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 33.4 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.62 -0.705 . . . . 10.0 110.029 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.449 ' H2 ' ' P ' ' C' ' 15' ' ' ' DT' . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 CA-C-O 120.918 0.389 . . . . 10.0 110.201 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.49 165.17 11.33 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.757 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -69.06 -58.95 3.41 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -133.42 94.71 3.36 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.469 HD12 H5'' ' C' ' 15' ' ' ' DT' . 28.7 tp -65.93 140.94 58.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.25 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 14.9 tppt? -75.28 131.14 40.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.398 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.516 ' CD1' ' H72' ' C' ' 14' ' ' ' DT' . 7.9 p90 -154.5 168.47 26.61 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.266 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.464 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.6 tp10 -155.86 128.2 7.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.8 mt -78.13 110.83 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.492 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 25.7 mm -80.92 -42.46 20.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.479 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -169.34 126.85 0.94 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.434 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -74.84 144.41 43.46 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 68.0 mt -115.8 -72.85 0.67 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.447 -0.501 . . . . 10.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.403 HD11 ' CB ' ' A' ' 68' ' ' GLU . 22.4 mm -127.86 142.93 42.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.281 0.562 . . . . 10.0 112.144 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.405 HG21 ' HG2' ' B' ' 26' ' ' GLU . 3.6 p -126.8 126.38 68.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 107.801 -1.185 . . . . 10.0 107.801 177.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 52.2 mt -93.91 -81.56 0.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.687 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.27 -172.31 0.3 Allowed 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.435 -0.579 . . . . 10.0 109.435 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -104.46 129.35 52.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -70.59 -174.92 0.95 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.998 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.83 -27.9 69.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.356 0.598 . . . . 10.0 110.841 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -88.42 0.7 55.95 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.78 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.36 2.04 83.2 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.117 -0.793 . . . . 10.0 111.117 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -60.0 105.51 0.4 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.001 0.429 . . . . 10.0 111.445 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.496 ' O ' ' HA ' ' B' ' 43' ' ' THR . 11.7 tpp85 -81.7 100.8 9.68 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.769 178.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -81.08 116.85 21.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.625 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . 0.405 ' HG2' HG21 ' B' ' 15' ' ' VAL . 62.9 mt-10 -135.31 152.87 51.9 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.978 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.454 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 38.4 tp -125.34 108.05 11.3 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -134.84 156.0 49.67 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.112 -177.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' B' ' 29' ' ' ARG . 39.5 ttm180 -89.59 114.57 26.18 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 m -125.78 156.41 35.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.775 0.321 . . . . 10.0 110.455 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.464 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.0 OUTLIER -94.09 124.28 38.01 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.362 179.184 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.651 ' CH2' ' H73' ' C' ' 17' ' ' ' DT' . 6.7 m0 -65.16 109.66 2.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 10.0 109.934 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.402 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.1 m-80 60.93 30.98 19.95 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.151 -178.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 66.36 22.07 10.85 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.801 -1.09 . . . . 10.0 110.778 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.08 -96.86 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.419 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.545 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 39.9 tt0 -78.66 122.85 85.35 Favored Pre-proline 0 C--O 1.234 0.24 0 CA-C-O 120.845 0.355 . . . . 10.0 111.854 -178.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.7 Cg_endo -79.66 124.02 5.56 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.913 2.409 . . . . 10.0 111.255 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -143.45 169.03 18.45 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.02 -0.363 . . . . 10.0 110.02 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.29 128.97 41.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -141.69 129.33 21.53 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 8.6 tt -105.23 122.81 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 10.0 110.084 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.499 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.0 mtt85 -145.04 -178.6 6.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.239 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.496 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -128.09 142.67 51.14 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 109.942 179.561 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -117.6 174.15 6.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.837 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.83 159.55 76.11 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.95 -26.6 82.81 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.332 2.021 . . . . 10.0 111.954 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -95.12 -5.52 43.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.037 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.84 31.35 20.72 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.538 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' B' ' 50' ' ' LYS . 11.5 pt-20 -81.49 -39.76 24.28 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.893 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . 0.437 ' N ' ' HG3' ' B' ' 49' ' ' GLU . 39.1 mmtm -139.43 173.05 11.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.808 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.444 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -146.78 172.38 13.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.524 -177.975 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.662 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -131.17 -154.69 7.94 Favored Glycine 0 C--O 1.228 -0.278 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.34 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -101.08 150.49 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 122.298 -0.531 . . . . 10.0 112.264 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.51 -123.14 1.88 Allowed Glycine 0 C--N 1.332 0.311 0 N-CA-C 110.595 -1.002 . . . . 10.0 110.595 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -147.93 142.59 19.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 117.653 0.726 . . . . 10.0 111.065 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 140.76 37.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.338 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 52.4 mt -126.2 126.79 44.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.095 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m -78.68 173.86 12.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.831 0.348 . . . . 10.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -57.16 -56.73 18.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.105 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.556 ' O ' HG22 ' B' ' 64' ' ' VAL . 11.7 pt-20 -61.16 -44.17 97.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.651 0.262 . . . . 10.0 111.494 -179.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.452 ' CD ' ' HZ1' ' A' ' 25' ' ' LYS . 50.2 mt-10 -62.77 -48.05 80.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.015 0.436 . . . . 10.0 110.749 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -64.64 -38.58 91.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.436 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.84 -53.66 44.42 Favored Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.117 -0.492 . . . . 10.0 112.549 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.556 HG22 ' O ' ' B' ' 60' ' ' GLU . 20.5 t -61.42 -43.33 96.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 10.0 110.047 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.4 tp -57.26 -52.48 65.15 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.615 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 80.9 mt -59.32 -51.51 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.18 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.1 tttm -48.52 -52.09 24.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.873 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.6 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 14.5 mm-40 -71.15 -48.12 53.78 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.951 -178.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.441 ' HB3' HD22 ' A' ' 66' ' ' LEU . 55.9 mt -58.89 -44.55 91.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.98 -41.11 99.64 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.924 -0.87 . . . . 10.0 110.924 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . 0.456 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 12.0 t-20 -67.08 -30.0 69.92 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.909 0.385 . . . . 10.0 111.258 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.7 mmtt -65.13 -31.34 72.48 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.312 -0.242 . . . . 10.0 111.146 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 26.5 mt -90.12 -5.85 56.06 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.718 -0.393 . . . . 10.0 111.642 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.456 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 28.1 mt-10 . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.622 -0.704 . . . . 10.0 110.47 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.513 -0.574 0 C3'-C2'-C1' 101.425 -0.91 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.512 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 C3'-C2'-C1' 101.538 -0.83 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.512 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.887 0 O4'-C1'-C2' 104.143 -1.779 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.693 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 O4'--C1' 1.429 0.718 0 O4'-C4'-C3' 103.58 -2.02 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.492 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.904 0 O4'-C4'-C3' 103.52 -2.08 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.797 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.776 0 C5'-C4'-O4' 113.145 2.34 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.907 0 C3'-C2'-C1' 101.302 -0.998 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.914 0 C3'-C2'-C1' 101.45 -0.893 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.844 0 C5'-C4'-O4' 108.567 -0.52 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.426 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C1'-C2' 104.277 -1.657 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.662 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.427 -0.835 0 O4'-C4'-C3' 103.585 -2.015 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.499 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 O4'-C4'-C3' 103.752 -1.848 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.734 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.953 0 C5'-C4'-O4' 113.036 2.273 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.651 ' H73' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.424 -0.978 0 C3'-C2'-C1' 100.969 -1.236 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.941 0.4 . . . . 10.0 110.177 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.76 162.53 13.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.9 -53.0 14.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -133.93 94.8 3.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.006 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.546 HD21 ' H72' ' C' ' 4' ' ' ' DT' . 21.9 tp -67.73 144.4 55.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.605 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -77.58 133.4 38.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.701 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -161.1 172.91 15.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.471 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.6 133.96 11.65 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.1 mt -83.8 107.9 15.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 120.985 0.421 . . . . 10.0 110.031 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.2 mm -76.0 -45.85 35.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -165.23 131.18 2.7 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.632 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.21 144.63 34.22 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 83.1 mt -113.7 -74.63 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.279 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.43 HD11 ' HB3' ' B' ' 68' ' ' GLU . 26.0 mm -132.1 139.15 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.246 0.546 . . . . 10.0 112.171 -177.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -120.17 122.21 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.851 -1.166 . . . . 10.0 107.851 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.0 mt -89.03 -80.67 0.29 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.533 -0.467 . . . . 10.0 111.917 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 m 179.2 -169.41 0.1 Allowed 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.407 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 32.9 mp0 -106.45 146.27 30.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.263 179.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -87.86 -170.39 2.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.48 ' O ' ' H72' ' C' ' 1' ' ' ' DT' . . . -64.27 -24.56 67.7 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.532 0.682 . . . . 10.0 110.71 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.457 ' HD3' H2'' ' C' ' 1' ' ' ' DT' . 31.1 mttt -93.9 3.28 55.61 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.061 -0.972 . . . . 10.0 110.757 -179.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.75 8.08 86.47 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.8 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.407 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -60.82 103.97 0.31 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.755 0.312 . . . . 10.0 111.5 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.1 tpp85 -81.58 99.26 8.74 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -85.37 117.82 24.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.918 0.39 . . . . 10.0 110.612 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -135.12 153.71 51.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.529 -0.759 . . . . 10.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.516 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 34.9 tp -123.16 107.23 11.5 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -135.79 154.96 51.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.315 -178.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 29' ' ' ARG . 8.1 ttp180 -91.24 115.05 27.71 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 178.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.5 m -123.85 160.43 27.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.696 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.471 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -97.29 122.83 40.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.349 179.059 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.5 m0 -63.64 110.97 2.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.898 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 58.36 30.29 19.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.41 0.624 . . . . 10.0 110.18 -178.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.9 t70 62.53 29.64 17.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.802 -1.09 . . . . 10.0 111.028 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.7 -74.98 0.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 O-C-N 122.103 -0.373 . . . . 10.0 111.49 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.51 112.69 50.04 Favored Pre-proline 0 C--N 1.328 -0.357 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.8 Cg_endo -80.45 120.18 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.392 2.061 . . . . 10.0 110.714 178.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttpt -152.35 172.22 16.8 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.843 -0.343 . . . . 10.0 110.482 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -91.06 134.94 34.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.675 0.274 . . . . 10.0 111.262 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -146.88 130.45 16.85 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.466 ' HB ' HD12 ' A' ' 27' ' ' LEU . 11.6 tt -107.14 123.45 62.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.283 0.563 . . . . 10.0 110.194 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.434 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.1 mtt85 -146.32 179.28 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.34 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -126.82 145.11 50.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.147 179.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -117.4 173.5 6.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.457 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -76.69 156.57 82.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.17 -33.08 95.24 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.396 2.064 . . . . 10.0 112.943 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -97.27 2.85 51.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.811 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 56.99 41.68 27.31 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.266 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.78 -37.21 14.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.622 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -142.21 174.36 10.68 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.019 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.438 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -136.68 172.43 13.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.458 -0.792 . . . . 10.0 111.234 -177.614 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.669 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -134.74 -165.89 10.98 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 121.182 -0.533 . . . . 10.0 111.917 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.6 mttp -94.53 156.16 16.58 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.024 -0.692 . . . . 10.0 111.988 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -150.67 -130.76 1.76 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.017 -0.833 . . . . 10.0 111.017 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 tt -144.23 143.72 23.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 117.723 0.761 . . . . 10.0 111.44 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.488 ' HB ' ' H72' ' C' ' 7' ' ' ' DT' . 1.3 m -102.73 144.2 31.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.966 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -125.01 131.53 53.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.379 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.492 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 1.0 OUTLIER -78.94 162.92 25.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.553 179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.9 -51.7 66.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -178.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.06 -44.68 97.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.777 0.323 . . . . 10.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.492 ' CD ' ' HG ' ' A' ' 58' ' ' SER . 79.8 mt-10 -62.19 -45.72 92.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.448 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.514 ' CE2' HD13 ' A' ' 66' ' ' LEU . 29.2 t80 -61.39 -42.61 99.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.019 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.48 -53.76 43.46 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.394 -0.432 . . . . 10.0 112.457 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.5 t -59.97 -41.63 86.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.986 0.422 . . . . 10.0 110.262 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.1 tp -59.97 -53.98 51.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.713 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.514 HD13 ' CE2' ' A' ' 62' ' ' PHE . 17.3 mt -60.89 -46.88 88.88 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.637 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.6 tttm -49.93 -55.28 15.06 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.735 0.647 . . . . 10.0 111.43 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 26.2 mm-40 -68.9 -45.45 70.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.736 -0.666 . . . . 10.0 111.788 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 67.4 mt -59.17 -45.41 91.08 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.898 0.38 . . . . 10.0 111.434 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.78 -36.74 93.77 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.932 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.405 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 6.8 t-20 -74.37 -28.48 61.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.807 0.337 . . . . 10.0 110.919 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.6 mmtt -66.86 -28.43 68.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.898 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.4 mt -85.4 -2.38 58.04 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.773 0.286 . . . . 10.0 111.773 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.405 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 46.9 mt-10 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.507 -0.759 . . . . 10.0 110.831 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 120.881 0.372 . . . . 10.0 110.116 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.28 163.17 13.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -75.54 -47.91 24.77 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -136.9 94.0 2.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.832 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.605 HD13 H5'' ' C' ' 15' ' ' ' DT' . 25.9 tp -67.64 143.05 56.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.592 179.4 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.523 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.7 tppt? -78.16 131.7 37.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.649 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.407 ' CD1' ' H71' ' C' ' 14' ' ' ' DT' . 9.3 p90 -159.49 174.43 14.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.843 179.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -156.56 133.19 10.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -83.59 104.17 11.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.16 0.505 . . . . 10.0 110.582 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.5 mm -71.8 -50.29 39.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.504 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -159.99 128.19 4.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.232 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -75.54 145.46 41.25 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.534 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 93.6 mt -116.61 -70.94 0.76 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.248 -0.581 . . . . 10.0 111.892 -179.369 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.421 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.2 mm -133.46 140.4 46.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.09 0.472 . . . . 10.0 111.654 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.88 119.82 57.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 107.589 -1.263 . . . . 10.0 107.589 177.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.5 mt -86.51 -81.42 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.453 -0.499 . . . . 10.0 111.971 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.54 -168.5 0.15 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.457 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 30.1 mp0 -108.97 142.06 40.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 178.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -82.57 -169.72 2.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.908 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.84 65.75 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.326 0.584 . . . . 10.0 111.012 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . 0.45 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 24.8 mttt -94.35 4.24 54.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.088 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.85 5.86 88.97 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.752 -0.737 . . . . 10.0 111.823 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.457 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -59.36 106.1 0.41 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.726 0.298 . . . . 10.0 111.452 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -83.58 99.76 10.38 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.4 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 92.5 mttt -84.95 117.71 24.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 110.818 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -134.76 154.05 51.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.949 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.534 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 46.7 tp -123.96 107.41 11.31 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 178.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -135.52 152.54 51.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.175 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -88.83 114.47 25.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.3 m -123.07 161.63 24.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.661 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 0.3 OUTLIER -97.51 123.94 41.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.89 0.376 . . . . 10.0 110.246 179.093 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.614 ' CH2' ' H73' ' C' ' 17' ' ' ' DT' . 6.0 m0 -64.07 109.4 1.81 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.839 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.523 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.7 m-80 59.46 30.23 19.88 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.109 -178.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.6 t70 63.53 29.55 15.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.994 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -122.58 -71.76 0.71 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.491 -0.322 . . . . 10.0 111.786 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.45 ' CD ' ' HZ3' ' B' ' 38' ' ' LYS . 47.5 tt0 -89.18 112.58 52.0 Favored Pre-proline 0 C--N 1.329 -0.316 0 N-CA-C 111.887 0.328 . . . . 10.0 111.887 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 56.3 Cg_endo -79.8 119.65 4.07 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.017 1.811 . . . . 10.0 110.562 178.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.45 ' HZ3' ' CD ' ' B' ' 36' ' ' GLU . 15.9 ttpt -151.42 173.5 14.48 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.719 -0.392 . . . . 10.0 110.171 -178.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -93.28 135.52 34.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.57 0.224 . . . . 10.0 111.159 -179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -147.44 129.81 15.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . 0.404 ' HB ' HD11 ' B' ' 27' ' ' LEU . 11.8 tt -105.7 123.29 60.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.247 0.546 . . . . 10.0 110.115 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.489 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.5 mtt85 -146.11 178.75 7.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.418 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.528 ' OG1' ' H71' ' C' ' 12' ' ' ' DT' . 0.0 OUTLIER -126.16 145.15 50.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.984 179.957 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -117.76 174.13 6.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.186 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 156.26 82.38 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 178.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.77 -36.42 98.55 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.433 2.088 . . . . 10.0 112.662 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.34 1.81 56.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.028 0.442 . . . . 10.0 110.697 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.59 44.99 20.03 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.11 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -93.5 -37.55 11.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.622 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -140.25 173.4 11.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.333 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.498 ' O ' " H1'" ' C' ' 13' ' ' ' DT' . 0.0 OUTLIER -135.86 170.74 15.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.985 -1.007 . . . . 10.0 110.819 -178.057 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.639 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -133.54 -165.95 11.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.127 -0.559 . . . . 10.0 111.762 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.6 151.94 18.91 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.139 -0.624 . . . . 10.0 111.872 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.58 -133.13 2.43 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.176 -0.92 . . . . 10.0 110.83 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -142.22 145.36 23.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 117.498 0.649 . . . . 10.0 111.478 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' THR . . . . . 0.486 ' HB ' ' H72' ' C' ' 17' ' ' ' DT' . 1.3 m -103.55 144.92 30.78 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.353 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.51 130.28 51.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.244 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' SER . . . . . 0.417 ' HG ' ' CD ' ' B' ' 61' ' ' GLU . 1.3 m -77.95 163.43 25.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -56.62 -52.73 63.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -58.98 -44.37 91.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 10.0 111.157 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.417 ' CD ' ' HG ' ' B' ' 58' ' ' SER . 66.6 mt-10 -63.95 -45.37 89.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.706 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.447 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.9 t80 -63.21 -39.69 95.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.328 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.87 -52.39 53.22 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.304 179.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 21.5 t -60.87 -43.97 96.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.088 0.471 . . . . 10.0 109.933 179.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.93 -55.53 33.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.917 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 52.5 mt -57.98 -50.74 72.34 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.354 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -49.38 -55.13 13.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.022 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.43 ' HB3' HD11 ' A' ' 14' ' ' ILE . 36.6 mm-40 -69.05 -45.85 69.33 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.88 -178.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.469 ' HB3' HD23 ' A' ' 66' ' ' LEU . 71.7 mt -60.88 -44.23 97.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.813 0.339 . . . . 10.0 111.648 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.32 -37.53 94.74 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.735 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . 0.477 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.3 t-20 -73.3 -31.47 64.05 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.843 0.354 . . . . 10.0 110.765 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.42 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.3 mmtt -64.09 -25.88 68.3 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.55 0.574 . . . . 10.0 112.55 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.405 ' CD1' ' HB3' ' A' ' 66' ' ' LEU . 26.0 mt -90.42 4.94 49.53 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.829 -0.348 . . . . 10.0 111.689 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.477 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.7 mt-10 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.325 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.48 ' H72' ' O ' ' A' ' 20' ' ' ALA . . . . . . . . 0 C2'--C1' 1.512 -0.635 0 C3'-C2'-C1' 101.599 -0.786 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.524 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.892 0 C3'-C2'-C1' 101.487 -0.866 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.524 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.967 0 O4'-C1'-C2' 104.089 -1.828 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.686 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 O4'-C4'-C3' 103.508 -2.092 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C4'-C3' 103.517 -2.083 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.849 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.433 0.963 0 C5'-C4'-O4' 113.123 2.327 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.488 ' H72' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 C3'-C2'-C1' 101.052 -1.177 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . 0.45 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 C3'-C2'-C1' 101.471 -0.878 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.528 ' H71' ' OG1' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.425 -0.926 0 C3'-C2'-C1' 101.767 -0.666 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.498 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 O4'-C1'-C2' 104.432 -1.517 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.694 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 O4'-C4'-C3' 103.498 -2.102 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.605 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.423 -1.055 0 O4'-C4'-C3' 103.71 -1.89 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.859 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.433 0.963 0 C5'-C4'-O4' 113.203 2.377 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.614 ' H73' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.427 -0.831 0 C3'-C2'-C1' 101.061 -1.17 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 CA-C-O 120.845 0.355 . . . . 10.0 110.558 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.64 168.53 9.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.194 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -64.74 -58.35 6.49 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -136.75 110.69 8.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.066 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.757 ' HB3' ' H73' ' C' ' 4' ' ' ' DT' . 26.0 tp -80.38 133.12 35.87 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 178.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.0 tppt? -67.65 133.79 49.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.829 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -158.1 168.03 28.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.42 . . . . 10.0 109.919 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.485 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 12.3 tp10 -149.19 125.54 10.86 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.886 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.4 mt -79.31 106.08 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.55 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.6 mm -72.06 -46.08 60.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.01 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.81 132.57 1.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.651 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -75.93 145.12 40.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.969 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 79.5 mt -112.65 -74.79 0.62 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.662 -0.415 . . . . 10.0 111.635 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.459 HD13 ' O ' ' A' ' 13' ' ' LEU . 30.6 mm -132.37 137.37 54.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.767 0.655 . . . . 10.0 112.767 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 p -118.85 125.36 74.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.1 mt -94.18 -81.32 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 10.0 112.073 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.0 m -172.88 -168.36 0.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.77 -0.456 . . . . 10.0 109.77 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 2.2 mp0 -112.37 135.06 53.52 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -73.27 -173.67 1.4 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.75 0.31 . . . . 10.0 110.728 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.82 -20.79 66.59 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.611 0.72 . . . . 10.0 109.896 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -91.1 -1.81 57.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.767 -1.106 . . . . 10.0 110.522 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 1.19 85.99 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.987 -0.845 . . . . 10.0 110.987 -178.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.514 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.2 m0 -60.27 108.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.82 0.343 . . . . 10.0 111.606 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.5 ' O ' ' HA ' ' A' ' 43' ' ' THR . 6.8 tpp85 -86.93 99.61 11.99 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.407 178.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.481 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 86.2 mttt -83.05 118.54 23.6 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.07 0.462 . . . . 10.0 110.587 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -133.52 145.17 49.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.853 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.55 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 40.7 tp -115.38 107.86 15.77 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -133.77 159.1 41.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.933 0.397 . . . . 10.0 110.958 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -94.08 114.09 26.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.1 m -127.31 158.77 38.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.896 0.379 . . . . 10.0 110.821 -179.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.485 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -98.41 125.53 43.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.958 0.409 . . . . 10.0 110.475 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -64.23 108.95 1.71 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.843 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 61.19 25.66 15.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.027 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.9 t70 66.89 21.81 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.794 -1.093 . . . . 10.0 110.437 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.12 -75.92 0.61 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.281 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -98.89 120.74 57.94 Favored Pre-proline 0 C--N 1.329 -0.292 0 N-CA-C 111.776 0.287 . . . . 10.0 111.776 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.3 Cg_endo -79.45 120.81 4.53 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.861 2.374 . . . . 10.0 111.477 178.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.9 ttmm -143.52 168.49 19.74 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -92.02 129.5 37.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.596 0.236 . . . . 10.0 110.694 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.447 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -141.83 132.46 25.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.8 tt -110.78 121.21 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.239 0.542 . . . . 10.0 110.048 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.497 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.8 mtt85 -143.23 -178.74 6.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.446 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.599 ' OG1' ' H72' ' C' ' 2' ' ' ' DT' . 0.1 OUTLIER -125.61 143.02 51.21 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.125 179.5 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -117.91 169.31 9.74 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.664 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.18 156.46 87.99 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.62 -27.81 84.04 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.267 1.978 . . . . 10.0 112.048 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -94.75 -0.86 53.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.817 -0.628 . . . . 10.0 110.417 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 58.71 31.37 21.09 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.718 -0.673 . . . . 10.0 111.004 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -82.08 -36.41 27.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.895 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -137.8 175.22 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.359 0.599 . . . . 10.0 111.332 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.41 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -135.1 172.21 13.33 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.86 -1.064 . . . . 10.0 110.558 -178.091 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.716 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.08 -164.9 10.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.971 -0.633 . . . . 10.0 112.157 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -96.31 151.74 19.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.937 -0.743 . . . . 10.0 112.073 -179.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.26 -126.98 1.53 Allowed Glycine 0 C--N 1.332 0.349 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.21 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 tt -142.98 145.06 23.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-N 117.599 0.7 . . . . 10.0 111.453 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -107.7 139.96 41.48 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.886 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 36.7 mt -124.19 132.31 53.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.889 0.376 . . . . 10.0 110.275 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 m -76.56 164.55 25.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.934 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -60.82 -44.04 97.43 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.701 0.259 . . . . 10.0 111.701 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -60.43 -47.29 86.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.197 0.522 . . . . 10.0 110.708 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HB3' HD13 ' B' ' 16' ' ' LEU . 38.6 mt-10 -64.03 -45.2 89.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.597 179.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.569 ' CE2' HD12 ' A' ' 66' ' ' LEU . 20.3 t80 -58.25 -44.45 88.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.329 -0.85 . . . . 10.0 111.005 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.54 -52.72 51.45 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.312 -0.47 . . . . 10.0 112.379 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.5 t -61.9 -42.85 96.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 120.969 0.414 . . . . 10.0 110.587 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.529 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.8 tp -57.42 -55.65 32.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.584 -0.735 . . . . 10.0 110.932 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.569 HD12 ' CE2' ' A' ' 62' ' ' PHE . 20.3 mt -63.25 -43.03 99.17 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.007 -0.277 . . . . 10.0 111.614 -179.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.3 ttpp -51.56 -51.54 54.52 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.424 0.453 . . . . 10.0 111.189 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 32.8 mm-40 -71.89 -44.18 64.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.394 -179.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 73.2 mt -58.8 -45.31 90.19 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.26 94.54 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.6 -0.809 . . . . 10.0 111.092 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.25 -29.69 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 10.0 110.591 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 34.3 mmtt -68.67 -25.25 64.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.22 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 37.4 mt -89.55 -0.79 57.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.666 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.138 -0.934 . . . . 10.0 111.019 -179.216 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.03 0.443 . . . . 10.0 110.553 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.98 164.78 11.69 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -62.57 -58.26 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.464 0.649 . . . . 10.0 109.449 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -134.15 112.92 11.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.056 -0.975 . . . . 10.0 109.36 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.617 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 32.2 tp -82.33 133.95 35.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.457 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.6 tppt? -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.948 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -155.48 163.84 39.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.254 -0.43 . . . . 10.0 109.842 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.478 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.5 tp10 -145.97 126.49 14.14 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.597 -0.52 . . . . 10.0 109.597 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 39.5 mt -79.6 108.78 13.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.453 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -74.86 -45.1 44.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.874 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -170.15 134.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.655 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -76.89 144.56 38.85 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.616 179.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 76.2 mt -113.76 -72.21 0.71 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.449 -0.5 . . . . 10.0 112.08 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.431 HD11 ' CB ' ' A' ' 68' ' ' GLU . 13.2 mm -131.52 139.15 51.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.038 0.447 . . . . 10.0 111.996 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 p -122.83 123.89 69.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.665 -1.235 . . . . 10.0 107.665 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 61' ' ' GLU . 41.4 mt -93.38 -82.06 0.35 Allowed 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.045 -0.662 . . . . 10.0 112.023 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.6 m -174.19 -167.9 0.36 Allowed 'General case' 0 C--O 1.236 0.388 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.516 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 2.0 mp0 -111.87 134.99 53.07 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 10.0 109.916 178.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -72.73 -175.87 1.82 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.51 66.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.518 0.675 . . . . 10.0 110.211 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -89.7 -3.49 58.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.265 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.94 3.37 79.95 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.234 -0.746 . . . . 10.0 111.234 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.516 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -61.59 108.58 1.0 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.686 0.279 . . . . 10.0 111.483 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.514 ' O ' ' HA ' ' B' ' 43' ' ' THR . 5.5 tpp85 -86.49 99.97 12.04 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.351 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.462 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 86.8 mttt -83.18 118.6 23.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.933 0.397 . . . . 10.0 110.761 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -133.91 144.48 48.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.748 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 38.9 tp -114.87 107.82 15.93 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -133.76 160.22 38.25 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.984 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -95.52 114.23 25.97 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 17.8 m -127.1 158.03 38.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.985 0.421 . . . . 10.0 110.587 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.478 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.2 p -97.35 126.05 42.34 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.032 0.444 . . . . 10.0 110.494 179.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.592 ' CH2' ' H72' ' C' ' 17' ' ' ' DT' . 9.3 m0 -64.21 108.71 1.64 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.492 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.457 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.5 m-80 60.34 26.43 15.95 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.836 0.71 . . . . 10.0 110.267 -178.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 67.25 22.29 9.69 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.046 -0.979 . . . . 10.0 110.922 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.41 -75.35 0.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.062 -0.399 . . . . 10.0 111.429 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.68 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 33.5 tt0 -98.86 118.78 62.38 Favored Pre-proline 0 C--N 1.33 -0.264 0 N-CA-C 111.71 0.263 . . . . 10.0 111.71 -178.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.478 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 61.7 Cg_endo -77.89 120.77 5.18 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.781 2.32 . . . . 10.0 111.514 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.425 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 21.1 ttmm -143.1 169.98 16.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . 0.425 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 22.4 m-85 -93.55 128.95 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.716 0.293 . . . . 10.0 110.556 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.439 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -141.43 132.39 26.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . 0.416 ' HB ' HD12 ' B' ' 27' ' ' LEU . 8.5 tt -110.71 122.07 64.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.257 0.551 . . . . 10.0 110.013 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.451 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 2.7 mtt85 -144.18 -179.74 6.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.209 -177.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.514 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -125.17 143.41 50.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.138 179.853 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -117.82 171.37 8.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.022 -0.536 . . . . 10.0 109.664 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -68.44 157.04 89.12 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -22.15 70.45 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.414 2.076 . . . . 10.0 111.859 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -100.72 0.07 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.13 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 58.34 30.05 19.02 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.075 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.1 -39.96 28.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.094 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -135.44 174.5 10.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 10.0 111.516 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -134.57 172.47 12.88 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.949 -1.023 . . . . 10.0 110.533 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.714 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.34 -161.95 9.01 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.127 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -99.44 147.08 25.65 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.989 -0.713 . . . . 10.0 112.142 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.98 -124.44 1.96 Allowed Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.144 -0.934 . . . . 10.0 110.777 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -145.82 146.46 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 117.556 0.678 . . . . 10.0 110.807 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.9 m -107.79 139.89 41.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.197 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.3 mt -124.25 132.29 53.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.234 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.23 166.78 22.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.179 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.26 -40.78 96.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.677 -0.238 . . . . 10.0 111.288 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.409 ' O ' HG21 ' B' ' 64' ' ' VAL . 9.4 pt-20 -63.76 -44.74 92.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.421 . . . . 10.0 110.511 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.452 ' OE2' ' HD2' ' A' ' 25' ' ' LYS . 36.1 mt-10 -66.47 -46.85 74.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.608 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.5 t80 -58.23 -39.26 78.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.438 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.61 -49.72 75.47 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.203 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.409 HG21 ' O ' ' B' ' 60' ' ' GLU . 8.2 t -66.5 -43.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.044 0.449 . . . . 10.0 110.432 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.3 tp -56.27 -54.73 41.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.887 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 48.9 mt -61.19 -47.82 84.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.126 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -50.49 -53.59 28.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.689 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 27.8 mm-40 -69.5 -47.17 64.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.844 -178.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.449 ' HB3' HD23 ' A' ' 66' ' ' LEU . 70.6 mt -60.13 -41.2 92.18 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.752 0.279 . . . . 10.0 111.752 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.21 -36.27 92.65 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.603 -0.808 . . . . 10.0 111.267 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -74.05 -29.66 62.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.077 0.465 . . . . 10.0 110.775 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 38.6 mmtt -65.56 -26.45 67.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.413 HD12 ' CB ' ' A' ' 66' ' ' LEU . 27.0 mt -89.44 3.24 52.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.694 0.283 . . . . 10.0 111.558 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.254 1.29 0 CA-C-O 118.567 -0.73 . . . . 10.0 110.105 179.694 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O5'-C5'-C4' 109.13 -0.764 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.599 ' H72' ' OG1' ' A' ' 43' ' ' THR . . . . . . . . 0 C2'--C1' 1.511 -0.717 0 C3'-C2'-C1' 101.363 -0.955 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.954 0 C1'-O4'-C4' 107.315 -1.704 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.757 ' H73' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.519 -0.897 0 O4'-C4'-C3' 103.506 -2.094 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.444 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 O4'-C4'-C3' 103.373 -2.227 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.751 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.9 0 C5'-C4'-O4' 113.044 2.278 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C3'-C2'-C1' 101.482 -0.87 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 C3'-C2'-C1' 101.612 -0.777 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 C3'-C2'-C1' 101.723 -0.698 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.419 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.843 0 O4'-C1'-C2' 104.528 -1.429 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.714 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O4'-C4'-C3' 103.433 -2.167 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.451 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.829 0 O4'-C4'-C3' 103.502 -2.098 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.735 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.429 0.67 0 C5'-C4'-O4' 113.034 2.271 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.68 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 C3'-C2'-C1' 100.525 -1.554 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.8 mtm . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 120.879 0.371 . . . . 10.0 110.539 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.12 160.29 14.39 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.417 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 13.0 t70 -62.19 -57.32 11.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.417 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 39.1 mmtm -138.29 94.29 2.85 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.549 HD23 ' H71' ' C' ' 4' ' ' ' DT' . 26.5 tp -64.7 137.8 58.02 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.6 tppt? -71.75 134.29 46.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.148 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.551 ' HB3' ' H73' ' C' ' 4' ' ' ' DT' . 13.0 p90 -159.58 170.12 22.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.006 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.432 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.13 133.52 11.81 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.285 -0.416 . . . . 10.0 109.938 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 70.7 mt -80.74 110.48 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.107 0.479 . . . . 10.0 110.418 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.4 mm -82.8 -39.61 15.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.215 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -167.3 139.35 3.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.841 -179.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.15 137.08 32.93 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 53.1 mt -104.55 -76.01 0.61 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.488 -0.485 . . . . 10.0 110.828 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.433 HD13 ' O ' ' A' ' 13' ' ' LEU . 26.6 mm -134.92 134.22 53.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.222 0.534 . . . . 10.0 111.848 -178.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -114.63 121.93 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.504 HD13 ' HA ' ' B' ' 61' ' ' GLU . 32.0 mt -89.38 -80.67 0.3 Allowed 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.496 -0.482 . . . . 10.0 111.837 -177.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.2 m -179.64 -168.57 0.12 Allowed 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.293 0.371 . . . . 10.0 110.058 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.1 mp0 -110.49 146.33 36.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.435 ' CG ' ' H ' ' A' ' 20' ' ' ALA . 11.9 t-20 -89.55 -168.82 2.27 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.132 -0.692 . . . . 10.0 109.132 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.622 ' O ' ' H71' ' C' ' 1' ' ' ' DT' . . . -64.28 -26.42 68.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.481 0.658 . . . . 10.0 111.006 -178.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -85.94 -0.14 54.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.218 -0.901 . . . . 10.0 110.837 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.25 2.98 90.37 Favored Glycine 0 N--CA 1.444 -0.773 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -58.56 108.89 0.69 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 111.467 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.5 tpp85 -79.96 108.93 13.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.17 178.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.549 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 61.5 mttt -88.89 109.82 20.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.194 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -133.28 149.3 51.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.627 0.727 . . . . 10.0 112.412 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.528 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 38.4 tp -122.36 108.54 13.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.518 -1.219 . . . . 10.0 107.882 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -134.16 166.28 23.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.304 0.574 . . . . 10.0 111.961 -177.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -98.71 114.33 26.8 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.6 m -128.71 156.83 41.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.761 0.315 . . . . 10.0 110.651 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.432 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.8 OUTLIER -93.51 123.91 37.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.252 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -64.4 108.82 1.73 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.784 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.408 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 60.74 30.3 19.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.932 -178.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t0 66.29 18.77 10.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.669 -1.151 . . . . 10.0 111.206 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.26 -93.1 0.28 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.599 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -84.94 126.59 67.61 Favored Pre-proline 0 C--O 1.233 0.22 0 CA-C-O 120.582 0.23 . . . . 10.0 111.593 -179.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.6 Cg_endo -81.0 120.42 3.76 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.042 2.495 . . . . 10.0 111.818 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -139.36 167.04 22.97 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -92.52 129.93 38.32 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.499 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t0 -139.88 132.94 29.53 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.892 -0.411 . . . . 10.0 109.892 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.416 ' HB ' ' CD1' ' A' ' 27' ' ' LEU . 13.7 tt -109.33 122.01 63.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.522 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtt85 -144.91 170.87 15.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.508 0.67 . . . . 10.0 112.103 -177.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.549 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.32 131.49 55.93 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 114.881 -1.054 . . . . 10.0 110.205 179.458 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -117.43 176.7 5.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.255 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.88 156.71 84.31 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -55.3 -37.5 94.47 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.729 2.286 . . . . 10.0 112.557 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -94.22 3.57 55.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.239 0.542 . . . . 10.0 110.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.8 m170 61.09 26.32 16.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.618 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.18 -35.06 77.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.728 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.4 mmtm -141.76 174.42 10.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.533 . . . . 10.0 111.291 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.88 172.29 11.84 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.457 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.569 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.93 -175.28 14.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.813 -0.708 . . . . 10.0 112.461 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -91.85 139.03 31.06 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.427 -0.455 . . . . 10.0 111.901 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -138.77 -121.2 1.9 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.369 -0.832 . . . . 10.0 111.174 179.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.3 tt -150.67 143.73 17.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.335 0.568 . . . . 10.0 111.012 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.413 ' HB ' ' H72' ' C' ' 7' ' ' ' DT' . 1.5 m -104.39 135.59 45.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.53 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.8 mt -113.9 121.99 45.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.58 176.92 9.26 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.8 -0.36 . . . . 10.0 110.448 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.78 -41.5 91.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.192 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.473 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 13.4 pt-20 -56.14 -47.88 77.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.336 0.589 . . . . 10.0 110.739 178.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.528 ' CD ' ' HZ2' ' B' ' 25' ' ' LYS . 30.1 mt-10 -67.16 -60.18 2.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.329 -0.851 . . . . 10.0 111.663 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.595 ' CE2' HD12 ' A' ' 66' ' ' LEU . 5.1 t80 -48.29 -45.11 34.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.235 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.69 34.85 Favored Glycine 0 C--O 1.237 0.313 0 C-N-CA 121.389 -0.434 . . . . 10.0 113.264 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.9 t -69.58 -43.62 80.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.736 0.303 . . . . 10.0 111.419 -179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.96 -52.45 65.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.431 -178.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.595 HD12 ' CE2' ' A' ' 62' ' ' PHE . 17.3 mt -62.93 -46.15 89.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 120.788 -0.365 . . . . 10.0 111.465 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -52.32 -50.42 62.29 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.598 0.562 . . . . 10.0 110.906 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.661 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 34.6 mm-40 -70.55 -50.15 40.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.813 -0.631 . . . . 10.0 111.947 -179.045 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.406 ' HB3' HD22 ' B' ' 66' ' ' LEU . 64.6 mt -55.89 -47.49 77.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.574 0.226 . . . . 10.0 111.58 -179.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.93 -31.22 80.21 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.601 -0.809 . . . . 10.0 111.592 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -74.37 -32.85 62.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.64 0.257 . . . . 10.0 111.116 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.661 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 33.3 mmtt -70.22 -24.24 63.06 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.71 0.29 . . . . 10.0 110.971 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 22.5 mt -85.05 -6.46 59.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.113 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.442 -0.79 . . . . 10.0 110.634 -179.542 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.871 0.367 . . . . 10.0 110.23 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.82 163.82 14.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.4 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 11.4 t0 -68.93 -55.12 11.98 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.4 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 40.8 mmtm -137.94 93.24 2.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.934 178.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.41 HD23 ' C6 ' ' C' ' 15' ' ' ' DT' . 34.6 tp -63.91 139.82 58.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.376 . . . . 10.0 110.656 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -74.33 134.88 42.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.852 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.436 ' CD1' ' H71' ' C' ' 14' ' ' ' DT' . 11.9 p90 -161.31 171.31 18.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.491 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -156.48 131.59 9.18 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -78.53 108.61 12.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.239 0.543 . . . . 10.0 110.534 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 24.5 mm -80.8 -40.52 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.936 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -166.79 138.91 3.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.621 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -84.22 139.63 32.23 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.4 mt -108.05 -73.42 0.69 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.433 -0.507 . . . . 10.0 111.274 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.467 HD13 ' HB3' ' A' ' 68' ' ' GLU . 14.7 mm -136.13 132.62 50.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.815 0.34 . . . . 10.0 111.761 -178.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.405 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -114.05 122.29 67.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 107.578 -1.268 . . . . 10.0 107.578 176.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.7 mt -88.31 -81.13 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.429 -0.509 . . . . 10.0 111.83 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 179.06 -169.21 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 11.5 mp0 -109.56 145.68 35.94 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.072 -0.344 . . . . 10.0 110.072 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . 0.411 ' CG ' ' H ' ' B' ' 20' ' ' ALA . 8.8 t-20 -88.09 -168.28 2.16 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . 0.411 ' H ' ' CG ' ' B' ' 19' ' ' ASN . . . -66.62 -22.27 66.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.192 0.52 . . . . 10.0 111.155 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -91.02 1.8 56.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 0.95 90.08 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.111 -0.796 . . . . 10.0 111.111 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.537 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -56.53 109.39 0.61 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.576 -0.312 . . . . 10.0 111.697 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.3 tpp85 -80.03 110.63 15.6 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.528 ' HZ2' ' CD ' ' A' ' 61' ' ' GLU . 61.0 mttt -90.04 110.86 21.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.394 -179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . 0.405 ' HG2' HG23 ' B' ' 15' ' ' VAL . 48.1 mt-10 -134.74 150.37 50.56 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.627 0.727 . . . . 10.0 112.333 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.511 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 35.3 tp -123.97 108.9 12.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.556 -1.202 . . . . 10.0 108.006 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -134.25 166.59 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.18 0.514 . . . . 10.0 111.828 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -98.05 113.75 25.72 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.32 -0.992 . . . . 10.0 108.32 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.5 m -128.74 155.46 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.887 0.375 . . . . 10.0 110.735 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -93.05 124.89 37.34 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.922 0.391 . . . . 10.0 110.584 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -64.44 109.32 1.9 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.689 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 60.3 29.9 19.39 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.539 0.685 . . . . 10.0 109.779 -178.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 41.7 t0 65.37 22.18 11.98 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.269 -1.332 . . . . 10.0 111.154 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.41 -89.18 0.38 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.488 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.605 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 34.5 tt0 -88.79 125.9 61.32 Favored Pre-proline 0 C--O 1.235 0.302 0 CA-C-O 120.705 0.288 . . . . 10.0 111.426 -178.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.4 Cg_endo -79.07 121.81 5.05 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.804 2.336 . . . . 10.0 111.582 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -140.49 164.31 30.47 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -90.75 127.68 36.41 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.511 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t0 -138.27 134.0 33.81 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 11.9 tt -110.21 120.95 62.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.511 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -143.9 169.84 17.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.543 0.687 . . . . 10.0 112.286 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.506 ' CG2' ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -113.21 131.13 56.01 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 114.838 -1.074 . . . . 10.0 110.356 179.467 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m0 -117.5 175.41 5.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.234 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.84 158.04 86.52 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -58.12 -33.02 96.94 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.529 2.152 . . . . 10.0 112.32 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -94.87 1.04 55.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.473 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 24.8 m170 62.28 24.27 14.43 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.284 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -66.99 -38.28 85.75 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.856 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -139.48 174.27 10.69 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.209 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.22 172.76 11.46 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.648 -178.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.488 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -139.9 -173.51 13.28 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.518 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 6.8 mtpp -93.64 136.31 34.05 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.243 -0.563 . . . . 10.0 111.863 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.406 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -134.96 -123.01 2.29 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 110.65 -0.98 . . . . 10.0 110.65 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.3 tt -150.43 143.05 17.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.39 0.595 . . . . 10.0 110.798 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.96 134.58 46.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.731 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 46.7 mt -112.69 120.24 40.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.96 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.06 174.97 11.06 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.935 -0.306 . . . . 10.0 110.414 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -58.37 -42.6 87.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.54 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.491 ' O ' HG21 ' B' ' 64' ' ' VAL . 12.1 pt-20 -55.91 -43.83 77.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.387 0.613 . . . . 10.0 110.678 178.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.546 ' CD ' ' HZ2' ' A' ' 25' ' ' LYS . 31.3 mt-10 -70.94 -58.58 3.44 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.365 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.446 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 0.8 OUTLIER -52.74 -40.62 63.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.594 -178.425 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.27 -56.33 24.25 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.905 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.491 HG21 ' O ' ' B' ' 60' ' ' GLU . 13.5 t -68.24 -44.79 83.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.844 0.354 . . . . 10.0 111.366 -179.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.1 tp -57.12 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.531 -178.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 23.4 mt -60.1 -52.74 64.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.6 0.238 . . . . 10.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttm -49.05 -51.71 29.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.642 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.675 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 55.2 mm-40 -69.56 -51.31 36.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.124 -0.489 . . . . 10.0 112.092 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.435 ' HB3' HD23 ' A' ' 66' ' ' LEU . 62.4 mt -57.05 -46.16 82.66 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.701 0.26 . . . . 10.0 111.701 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.35 93.28 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.282 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . 0.401 ' HA ' ' HG3' ' B' ' 74' ' ' GLU . 2.0 t-20 -72.06 -30.83 65.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.58 -0.31 . . . . 10.0 111.688 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.675 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 13.9 mmtt -69.36 -25.48 64.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.541 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.412 ' CD1' ' HB3' ' A' ' 66' ' ' LEU . 19.1 mt -88.62 -2.76 58.76 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.384 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.401 ' HG3' ' HA ' ' B' ' 71' ' ' ASN . 36.6 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.955 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.622 ' H71' ' O ' ' A' ' 20' ' ' ALA . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C3'-C2'-C1' 101.902 -0.57 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.418 ' H71' ' O ' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 C3'-C2'-C1' 101.348 -0.965 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -0.968 0 O4'-C1'-C2' 104.184 -1.742 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.653 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 O4'-C4'-C3' 103.408 -2.192 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.453 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 O4'-C4'-C3' 103.546 -2.054 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.865 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.904 0 C5'-C4'-O4' 113.184 2.365 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.413 ' H72' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 C3'-C2'-C1' 101.166 -1.096 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.843 0 C3'-C2'-C1' 101.167 -1.095 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C3'-C2'-C1' 101.93 -0.55 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.929 0 O4'-C1'-C2' 104.348 -1.592 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.561 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.835 0 O4'-C4'-C3' 103.528 -2.072 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.445 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 O4'-C4'-C3' 103.857 -1.743 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.832 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.822 0 C5'-C4'-O4' 113.092 2.308 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.605 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.425 -0.931 0 C3'-C2'-C1' 100.82 -1.343 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.789 0.328 . . . . 10.0 110.426 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.47 163.53 13.37 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -72.28 -50.86 23.9 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.611 -0.514 . . . . 10.0 109.611 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -134.77 94.57 3.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.887 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.936 ' HB3' ' H73' ' C' ' 4' ' ' ' DT' . 23.3 tp -68.46 140.53 55.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.463 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -74.53 131.47 41.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.616 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -158.03 171.83 19.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.393 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.412 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.27 135.19 12.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.346 -0.612 . . . . 10.0 109.346 178.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.403 ' HA ' HG12 ' A' ' 30' ' ' VAL . 65.1 mt -83.38 117.47 29.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 mm -84.95 -49.25 15.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.293 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -165.77 134.17 3.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.263 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -79.47 137.83 37.36 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.276 -0.638 . . . . 10.0 109.276 178.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 87.9 mt -105.75 -72.1 0.72 Allowed 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.793 -0.363 . . . . 10.0 111.467 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.467 HD11 ' O ' ' A' ' 13' ' ' LEU . 27.2 mm -131.75 140.86 47.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.094 0.474 . . . . 10.0 111.924 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.76 120.8 58.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 108.11 -1.07 . . . . 10.0 108.11 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.455 HD22 ' HB ' ' B' ' 64' ' ' VAL . 25.6 mt -91.02 -80.77 0.33 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.159 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.4 ' H ' ' HB2' ' A' ' 16' ' ' LEU . 3.4 m 179.36 -170.38 0.13 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 -179.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -106.67 140.08 40.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.817 0.341 . . . . 10.0 110.239 179.004 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -77.48 -174.63 3.43 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.01 -24.47 67.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.536 0.684 . . . . 10.0 110.837 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.409 ' HB3' H2'' ' C' ' 1' ' ' ' DT' . 20.7 mttt -90.21 3.02 54.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.155 -0.93 . . . . 10.0 110.692 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.06 6.01 87.01 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.207 -0.757 . . . . 10.0 111.207 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.433 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.6 m0 -62.1 100.33 0.16 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.839 0.352 . . . . 10.0 111.346 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 43' ' ' THR . 13.3 tpp85 -81.12 99.42 8.5 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HZ2' ' CD ' ' B' ' 61' ' ' GLU . 89.9 mttt -83.5 112.23 19.78 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.864 0.364 . . . . 10.0 110.52 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -131.55 149.31 52.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.842 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 38.3 tp -118.3 108.16 14.76 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.099 -1.075 . . . . 10.0 108.099 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -133.38 160.7 36.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 10.0 111.152 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -96.79 114.97 26.65 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' A' ' 9' ' ' ILE . 17.2 m -127.92 160.47 37.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.801 0.334 . . . . 10.0 110.569 -179.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.6 p -96.58 122.53 39.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.926 0.393 . . . . 10.0 110.453 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.46 ' CH2' ' H73' ' C' ' 7' ' ' ' DT' . 5.2 m0 -64.2 109.97 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.014 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.488 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.2 m-80 59.12 31.0 20.91 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.781 0.676 . . . . 10.0 110.158 -178.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t70 61.61 30.06 18.47 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.763 -1.108 . . . . 10.0 110.959 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.75 -77.83 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.058 -0.402 . . . . 10.0 111.705 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -97.12 120.47 61.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 120.631 0.253 . . . . 10.0 111.589 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 69.0 Cg_endo -78.62 120.85 4.9 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.484 2.123 . . . . 10.0 111.325 178.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -141.25 168.5 19.62 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -93.26 130.47 38.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.437 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -141.54 130.02 22.56 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.4 tt -106.32 121.31 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.345 0.593 . . . . 10.0 109.953 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.479 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.9 mtt85 -144.65 177.6 8.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.19 -177.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.56 ' OG1' ' H71' ' C' ' 2' ' ' ' DT' . 0.0 OUTLIER -120.77 142.22 49.77 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.497 179.197 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -117.01 176.63 5.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.29 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.3 p -79.39 158.38 74.04 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -58.75 -30.86 93.75 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.53 2.153 . . . . 10.0 112.162 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -94.27 -5.35 46.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.834 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 60.83 34.59 19.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.6 -178.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -88.26 -32.51 18.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.472 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.0 mmtm -141.84 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.119 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.443 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -145.42 172.73 12.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.278 -177.701 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.675 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -133.63 -154.82 7.49 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.092 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.5 mttp -101.58 157.3 16.92 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 122.169 -0.607 . . . . 10.0 112.066 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.81 -122.36 0.99 Allowed Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.775 -0.93 . . . . 10.0 110.775 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -149.38 141.42 17.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 117.759 0.78 . . . . 10.0 111.367 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.51 144.67 31.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -129.79 130.66 45.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.113 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -84.97 175.21 9.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.774 -0.194 . . . . 10.0 110.905 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -53.69 -58.68 6.32 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.49 0.552 . . . . 10.0 112.49 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -57.69 -49.01 77.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.757 0.313 . . . . 10.0 111.829 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.484 ' CD ' ' HZ3' ' B' ' 25' ' ' LYS . 50.4 mt-10 -58.99 -49.0 79.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.204 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -62.62 -44.07 97.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.486 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.53 -54.56 36.21 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.101 -0.499 . . . . 10.0 112.917 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.2 -42.14 89.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.295 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -57.59 -53.06 62.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.462 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.437 HD21 ' HB3' ' B' ' 69' ' ' LEU . 17.2 mt -62.18 -46.14 90.26 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 -179.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -51.27 -51.35 54.99 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 123.635 0.584 . . . . 10.0 111.522 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 49.9 mm-40 -70.24 -46.69 63.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.339 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 69.0 mt -58.53 -44.15 89.47 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 111.682 0.253 . . . . 10.0 111.682 -179.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.57 -38.87 97.09 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.824 -0.703 . . . . 10.0 111.596 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -71.37 -29.05 64.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.813 0.34 . . . . 10.0 110.755 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 54.5 mmtt -66.55 -25.11 66.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.362 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.402 HD11 ' HB3' ' B' ' 66' ' ' LEU . 24.2 mt -85.68 -11.93 52.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.448 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.706 -0.664 . . . . 10.0 110.635 179.947 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.859 0.361 . . . . 10.0 110.446 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.01 160.57 16.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.401 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 14.8 t70 -72.22 -48.37 43.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.401 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 32.8 mmtm -135.05 94.46 3.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.66 -0.7 . . . . 10.0 109.546 179.006 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.445 HD12 H5'' ' C' ' 15' ' ' ' DT' . 26.9 tp -68.84 140.32 55.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.407 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.479 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -74.05 129.72 38.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.597 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.602 ' CD1' ' H72' ' C' ' 14' ' ' ' DT' . 9.9 p90 -158.01 170.04 23.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.064 -0.517 . . . . 10.0 110.263 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.433 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 6.2 tp10 -152.63 133.05 13.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.506 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 63.7 mt -82.07 117.81 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.093 0.473 . . . . 10.0 110.124 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 39.5 mm -85.24 -50.82 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.377 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 -162.94 133.38 4.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.43 142.64 37.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.1 mt -112.43 -67.95 0.96 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.64 -0.424 . . . . 10.0 111.677 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.403 HG23 HD12 ' B' ' 14' ' ' ILE . 21.2 mm -133.03 141.38 44.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.826 0.346 . . . . 10.0 111.787 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -128.31 116.74 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 177.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 34.6 mt -86.14 -81.07 0.22 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.616 -177.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 178.99 -168.48 0.09 Allowed 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.473 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 0.8 OUTLIER -108.39 141.37 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.154 -0.313 . . . . 10.0 110.154 178.841 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -78.82 -172.76 3.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.25 66.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 10.0 110.879 -179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . 0.441 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 22.6 mttt -93.24 2.74 56.5 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.376 -0.829 . . . . 10.0 110.198 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.43 5.5 84.86 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.664 -0.779 . . . . 10.0 111.436 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.473 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -61.33 101.61 0.18 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.867 0.365 . . . . 10.0 111.641 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.485 ' O ' ' HA ' ' B' ' 43' ' ' THR . 14.1 tpp85 -81.63 99.72 9.03 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.484 ' HZ3' ' CD ' ' A' ' 61' ' ' GLU . 90.5 mttt -83.46 113.6 20.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.974 0.416 . . . . 10.0 110.907 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -132.98 148.95 52.27 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.639 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.485 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 38.8 tp -119.3 107.62 13.62 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 178.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -133.18 161.33 34.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.968 0.413 . . . . 10.0 111.211 -177.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -97.7 114.68 26.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 23.0 m -127.28 159.92 36.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.518 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.477 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.2 p -95.01 122.85 38.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 10.0 110.775 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.563 ' CH2' ' H71' ' C' ' 17' ' ' ' DT' . 5.8 m0 -64.27 110.45 2.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.783 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.479 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 65.1 m-80 59.43 29.26 18.8 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.23 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 64.11 24.81 13.58 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.834 -1.075 . . . . 10.0 110.903 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.9 -82.98 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.764 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.463 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 34.4 tt0 -92.42 120.41 67.53 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 10.0 111.63 -178.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.477 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.2 Cg_endo -76.84 124.05 7.22 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.617 2.212 . . . . 10.0 111.124 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -144.28 165.94 26.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -92.0 129.52 37.94 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.438 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -140.26 130.01 24.45 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 9.1 tt -105.53 121.59 57.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 10.0 109.951 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.454 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 2.9 mtt85 -145.04 176.85 9.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.398 -177.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -120.56 142.2 49.57 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.645 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -116.92 177.34 4.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.028 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -80.97 159.48 68.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.49 -28.79 88.37 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.385 2.056 . . . . 10.0 112.073 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.35 -5.75 42.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.641 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 62.53 28.35 16.68 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.984 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.55 -36.42 29.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.713 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -138.51 172.56 12.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.452 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.432 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -146.78 172.46 13.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.418 -177.761 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.583 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -132.82 -154.67 7.61 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.676 -0.773 . . . . 10.0 112.161 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.51 156.09 17.48 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 122.2 -0.588 . . . . 10.0 111.953 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.1 -121.17 1.11 Allowed Glycine 0 N--CA 1.452 -0.297 0 N-CA-C 110.761 -0.936 . . . . 10.0 110.761 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.416 HD11 HG21 ' B' ' 55' ' ' ILE . 12.2 tt -151.43 141.38 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 117.74 0.77 . . . . 10.0 111.166 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.96 145.67 29.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.591 -179.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 32.6 mt -128.95 128.83 44.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.272 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -83.57 173.36 11.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.696 -0.229 . . . . 10.0 110.867 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -51.86 -56.6 13.04 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.539 ' O ' HG22 ' B' ' 64' ' ' VAL . 11.5 pt-20 -60.53 -47.09 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.808 0.299 . . . . 10.0 111.808 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.485 ' CD ' ' HZ2' ' A' ' 25' ' ' LYS . 46.8 mt-10 -61.32 -47.44 85.93 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.38 . . . . 10.0 110.974 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -66.14 -40.12 90.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.807 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.07 -53.72 43.25 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.093 -0.503 . . . . 10.0 112.857 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.539 HG22 ' O ' ' B' ' 60' ' ' GLU . 14.1 t -62.31 -41.7 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 120.979 0.419 . . . . 10.0 110.119 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.2 tp -58.25 -52.44 65.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.453 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.45 HD23 ' HB3' ' A' ' 69' ' ' LEU . 49.6 mt -60.36 -48.71 80.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.331 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -50.34 -53.79 26.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 10.0 111.918 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 65.5 mm-40 -69.79 -47.32 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.015 -0.538 . . . . 10.0 111.933 -178.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.437 ' HB3' HD21 ' A' ' 66' ' ' LEU . 59.9 mt -59.91 -44.29 94.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.904 0.335 . . . . 10.0 111.904 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.16 -36.48 93.02 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.466 -0.873 . . . . 10.0 111.289 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.46 -28.39 61.02 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.699 0.285 . . . . 10.0 111.153 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.8 mmtt -65.45 -24.46 67.18 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 111.968 0.359 . . . . 10.0 111.968 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 23.2 mt -88.85 -4.28 58.52 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.722 -0.391 . . . . 10.0 111.53 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.644 -0.694 . . . . 10.0 110.116 179.35 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.409 H2'' ' HB3' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 101.643 -0.755 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.56 ' H71' ' OG1' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C3'-C2'-C1' 101.459 -0.886 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.431 " H1'" ' O ' ' A' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 O4'-C1'-C2' 104.331 -1.608 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.936 ' H73' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 O4'-C4'-C3' 103.613 -1.987 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.618 H5'' HD11 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C4'-C3' 103.587 -2.013 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.771 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.858 0 C5'-C4'-O4' 113.075 2.297 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.46 ' H73' ' CH2' ' A' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.424 -0.989 0 C3'-C2'-C1' 101.391 -0.935 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . 0.582 ' OP2' " H4'" ' C' ' 11' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 101.3 -1.0 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.968 0 C3'-C2'-C1' 101.805 -0.639 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.431 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.409 -0.849 0 O4'-C1'-C2' 104.348 -1.593 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.622 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 O4'-C4'-C3' 103.542 -2.058 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.454 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.869 0 O4'-C4'-C3' 103.762 -1.838 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.769 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.933 0 C5'-C4'-O4' 113.133 2.333 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.563 ' H71' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.425 -0.954 0 C3'-C2'-C1' 101.133 -1.119 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mmt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.976 0.417 . . . . 10.0 110.265 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.33 172.17 6.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.273 -0.421 . . . . 10.0 109.917 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.567 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 32.2 t70 -76.86 -57.0 4.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.011 0.434 . . . . 10.0 110.001 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 38.5 mmtm -135.42 95.38 3.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.873 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.588 HD11 H5'' ' C' ' 5' ' ' ' DT' . 23.9 tp -64.52 141.76 58.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.801 0.334 . . . . 10.0 110.532 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -77.21 131.7 38.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.221 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -155.43 174.25 15.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.501 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.541 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.52 127.07 7.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.908 179.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 53.6 mt -81.54 111.81 18.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.141 0.496 . . . . 10.0 109.727 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.404 HG13 ' HB3' ' A' ' 37' ' ' PRO . 29.8 mm -80.28 -50.89 16.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.506 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -159.86 130.31 5.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.418 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -74.44 142.61 44.92 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 73.4 mt -110.64 -75.18 0.63 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.294 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.417 HD13 ' O ' ' A' ' 13' ' ' LEU . 27.8 mm -132.45 140.96 46.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.227 0.537 . . . . 10.0 112.146 -177.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.86 123.58 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 107.962 -1.125 . . . . 10.0 107.962 177.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.414 HD22 ' HB ' ' B' ' 64' ' ' VAL . 31.0 mt -94.65 -81.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.531 -0.468 . . . . 10.0 112.208 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 m -176.34 -168.38 0.25 Allowed 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.421 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -106.6 147.56 29.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.754 179.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -83.61 -172.78 4.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.19 -26.22 68.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.819 0.819 . . . . 10.0 109.911 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.416 ' HG2' ' C2 ' ' C' ' 1' ' ' ' DT' . 20.2 mttt -88.67 -0.6 57.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.739 -1.118 . . . . 10.0 111.025 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.76 5.1 81.86 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.619 -0.8 . . . . 10.0 111.5 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.421 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -62.41 106.76 0.8 Allowed 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.866 0.365 . . . . 10.0 111.187 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.5 tpp85 -82.94 100.06 10.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.551 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.492 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 92.3 mttt -81.39 116.57 21.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.881 0.372 . . . . 10.0 110.56 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -132.97 152.24 51.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.084 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.525 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 46.3 tp -121.28 108.16 13.39 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 107.79 -1.189 . . . . 10.0 107.79 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -132.17 159.57 38.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 10.0 110.794 -178.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -96.9 113.65 25.2 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.284 -1.006 . . . . 10.0 108.284 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.4 m -127.37 158.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.776 0.322 . . . . 10.0 110.894 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.541 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -95.83 125.03 40.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.633 179.103 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.9 m0 -64.23 107.61 1.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.674 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.2 m-80 61.21 31.12 19.54 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.513 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.9 t0 66.33 17.08 10.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.056 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.82 -85.08 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.087 -0.383 . . . . 10.0 111.818 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -96.18 122.61 57.54 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 111.922 0.342 . . . . 10.0 111.922 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.7 Cg_endo -77.27 125.3 7.7 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.067 2.511 . . . . 10.0 111.676 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -143.35 167.98 20.88 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -93.96 126.38 39.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.209 -0.293 . . . . 10.0 110.209 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.448 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -138.27 133.2 32.81 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 14.5 tt -108.2 121.25 60.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.353 0.597 . . . . 10.0 109.956 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.535 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtt85 -144.44 -179.84 6.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.234 -177.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -123.73 145.38 49.05 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.688 179.267 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.5 m95 -117.48 168.44 10.38 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.96 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.1 m -66.79 157.74 82.68 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 178.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -51.7 -31.7 42.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.093 2.529 . . . . 10.0 113.28 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -107.5 11.92 28.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.226 0.536 . . . . 10.0 110.459 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 54.3 m80 59.03 25.36 13.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.949 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -73.84 -39.67 63.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.734 0.302 . . . . 10.0 111.084 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -133.51 175.42 9.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.316 0.579 . . . . 10.0 111.087 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -140.43 172.78 12.25 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.497 -178.31 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.729 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -138.44 -161.55 8.85 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.583 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -97.77 146.0 25.82 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 122.279 -0.542 . . . . 10.0 112.331 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.402 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -143.15 -126.99 2.08 Favored Glycine 0 CA--C 1.519 0.299 0 N-CA-C 111.097 -0.801 . . . . 10.0 111.097 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 tt -146.77 142.93 20.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 117.888 0.844 . . . . 10.0 111.519 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.0 144.66 30.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.785 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.1 mt -123.77 131.38 53.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.573 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.447 ' HG ' ' CD ' ' A' ' 61' ' ' GLU . 1.3 m -77.92 171.67 14.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.943 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -64.54 -46.54 82.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.506 0.193 . . . . 10.0 111.248 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.17 -43.8 95.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.231 0.539 . . . . 10.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' CD ' ' HG ' ' A' ' 58' ' ' SER . 74.0 mt-10 -65.28 -52.66 52.8 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.113 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.597 ' CE2' HD13 ' A' ' 66' ' ' LEU . 21.1 t80 -56.25 -43.72 78.98 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.343 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.68 -54.11 39.75 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.14 -0.552 . . . . 10.0 112.729 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 89.4 t -62.22 -42.47 95.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.768 0.318 . . . . 10.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.445 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 14.9 tp -58.53 -52.58 65.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.402 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.597 HD13 ' CE2' ' A' ' 62' ' ' PHE . 19.4 mt -61.87 -46.05 91.13 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.483 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -51.54 -52.82 43.93 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 123.456 0.473 . . . . 10.0 111.194 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 70.6 mm-40 -68.68 -46.75 68.23 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.711 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 79.9 mt -60.14 -43.67 95.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.683 0.277 . . . . 10.0 111.411 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.61 -33.99 88.73 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.72 -0.753 . . . . 10.0 111.346 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -73.98 -28.37 61.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.882 0.373 . . . . 10.0 110.786 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.64 -27.5 66.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.967 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.0 mt -90.0 -5.25 56.85 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.735 0.272 . . . . 10.0 111.735 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.656 -0.687 . . . . 10.0 110.665 -179.705 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.931 0.396 . . . . 10.0 109.976 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.53 168.18 9.43 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.429 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 36.1 t70 -76.49 -53.32 8.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.055 0.455 . . . . 10.0 110.078 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.429 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 38.2 mmtm -136.29 94.54 3.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.685 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.623 HD13 H5'' ' C' ' 15' ' ' ' DT' . 25.6 tp -65.4 139.26 58.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.856 0.36 . . . . 10.0 110.602 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.478 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.2 tppt? -75.58 130.69 39.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.57 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.656 ' CD1' ' H72' ' C' ' 14' ' ' ' DT' . 9.6 p90 -153.94 174.3 14.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.196 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.516 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.8 tp10 -155.11 122.37 5.56 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.806 179.097 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . 0.454 ' HA ' HG12 ' B' ' 30' ' ' VAL . 44.7 mt -77.65 109.83 12.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 28.6 mm -79.01 -51.83 16.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.664 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -158.87 127.97 5.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.265 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -72.26 145.06 48.16 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 53.1 mt -113.29 -72.12 0.72 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.488 -179.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 18.9 mm -133.17 140.63 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 10.0 112.052 -177.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.6 p -123.48 123.77 68.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 107.969 -1.123 . . . . 10.0 107.969 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 30.5 mt -94.92 -81.19 0.4 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.473 -0.491 . . . . 10.0 112.012 -177.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.46 -168.42 0.15 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 -179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.424 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -106.87 147.57 29.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 10.0 110.271 179.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -83.69 -168.0 1.94 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.141 -0.482 . . . . 10.0 109.75 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.1 -23.45 64.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.282 0.563 . . . . 10.0 110.356 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -91.78 1.03 57.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.419 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.82 4.66 82.19 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.51 -0.852 . . . . 10.0 111.636 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -61.94 106.16 0.67 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.742 0.306 . . . . 10.0 110.973 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.476 ' O ' ' HA ' ' B' ' 43' ' ' THR . 7.9 tpp85 -83.02 100.43 10.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.809 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.443 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 93.3 mttt -81.03 116.97 21.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 10.0 110.891 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -132.57 150.39 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.937 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.493 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 41.2 tp -120.14 107.94 13.63 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.95 -1.13 . . . . 10.0 107.95 178.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -133.27 158.0 44.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.939 0.4 . . . . 10.0 111.159 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -94.93 114.0 25.79 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.414 -0.958 . . . . 10.0 108.414 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.454 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.2 m -128.16 156.15 40.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.362 . . . . 10.0 110.883 -178.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.516 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.7 OUTLIER -95.11 125.58 39.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.033 0.444 . . . . 10.0 110.626 179.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.408 ' CH2' ' H72' ' C' ' 17' ' ' ' DT' . 10.5 m0 -64.24 110.11 2.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.956 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.478 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.7 m-80 60.6 28.71 18.41 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.667 0.604 . . . . 10.0 110.356 -178.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 40.4 t0 62.66 32.22 16.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.037 -0.983 . . . . 10.0 110.214 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.62 -82.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.025 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -98.16 122.38 54.35 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-O 120.646 0.26 . . . . 10.0 111.515 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 70.3 Cg_endo -77.12 121.78 5.92 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.809 2.339 . . . . 10.0 111.654 178.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -139.75 167.5 21.96 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -95.04 126.83 40.65 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.463 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -138.15 132.82 32.52 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.611 -0.515 . . . . 10.0 109.611 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . 0.411 HG22 HD12 ' B' ' 41' ' ' ILE . 11.9 tt -106.44 121.76 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.183 0.516 . . . . 10.0 109.73 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.529 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.0 mtt85 -144.87 178.48 7.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.268 0.556 . . . . 10.0 111.599 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.523 ' HG1' ' H72' ' C' ' 12' ' ' ' DT' . 0.1 OUTLIER -121.86 145.0 48.51 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.573 -0.739 . . . . 10.0 109.743 179.453 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -117.73 167.09 11.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.673 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 16.6 m -66.35 157.98 79.69 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.504 -0.554 . . . . 10.0 109.504 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -51.48 -33.24 46.48 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.975 2.45 . . . . 10.0 112.908 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -105.1 11.29 33.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.102 0.477 . . . . 10.0 110.91 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.2 m80 57.76 27.66 14.75 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.38 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.23 -39.85 59.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.825 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -134.68 175.17 9.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 10.0 111.132 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' MET . . . . . 0.423 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -141.19 172.63 12.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.257 -0.883 . . . . 10.0 110.363 -178.111 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.693 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.63 -159.97 8.25 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.566 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -97.41 146.47 25.16 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.184 -0.598 . . . . 10.0 112.241 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.4 -129.02 2.34 Favored Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -147.48 140.9 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 117.666 0.733 . . . . 10.0 111.22 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' THR . . . . . 0.447 ' HB ' ' H71' ' C' ' 17' ' ' ' DT' . 0.2 OUTLIER -100.83 147.92 25.54 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.16 -179.796 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 87.6 mt -126.52 132.94 51.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.383 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' SER . . . . . 0.409 ' HG ' ' CD ' ' B' ' 61' ' ' GLU . 1.3 m -79.92 169.52 17.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.27 -47.95 83.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 10.0 111.145 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.653 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.5 pt-20 -58.57 -44.31 89.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.608 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.419 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 65.6 mt-10 -66.48 -52.73 43.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.023 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.477 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.1 t80 -57.16 -41.56 79.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.858 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.75 -53.46 45.79 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.27 -0.491 . . . . 10.0 112.84 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.653 HG23 ' O ' ' B' ' 60' ' ' GLU . 15.6 t -62.97 -43.51 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.877 0.37 . . . . 10.0 110.503 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.1 tp -58.33 -51.98 67.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.358 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 62.1 mt -60.1 -49.61 76.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.812 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -50.74 -54.62 21.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.661 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 39.6 mm-40 -67.42 -47.57 69.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.053 -0.521 . . . . 10.0 112.027 -178.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.44 ' HB3' HD22 ' A' ' 66' ' ' LEU . 72.5 mt -61.75 -42.12 98.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.5 0.19 . . . . 10.0 111.455 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.73 -37.37 94.71 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -72.02 -28.81 63.62 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.023 0.44 . . . . 10.0 110.911 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.5 mmtt -64.44 -32.27 73.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.065 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 24.9 mt -90.66 6.06 45.49 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.794 -0.622 . . . . 10.0 109.788 179.209 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.416 ' C2 ' ' HG2' ' A' ' 21' ' ' LYS . . . . . . . . 0 C2'--C1' 1.512 -0.659 0 C3'-C2'-C1' 101.63 -0.764 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 101.596 -0.789 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.404 ' H6 ' " H2'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -1.014 0 O4'-C1'-C2' 104.266 -1.668 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.729 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 C4'--C3' 1.52 -0.793 0 O4'-C4'-C3' 103.47 -2.13 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.588 H5'' HD11 ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.757 0 O4'-C4'-C3' 103.361 -2.239 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.789 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.885 0 C5'-C4'-O4' 113.218 2.386 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.924 0 C3'-C2'-C1' 101.111 -1.135 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.969 0 C3'-C2'-C1' 101.316 -0.989 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.523 ' H72' ' HG1' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.424 -0.997 0 C3'-C2'-C1' 101.785 -0.653 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 O4'-C1'-C2' 104.344 -1.597 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.693 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.427 -0.812 0 O4'-C4'-C3' 103.531 -2.069 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.623 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.838 0 O4'-C4'-C3' 103.629 -1.971 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.79 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.932 0 C5'-C4'-O4' 113.056 2.285 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.447 ' H71' ' HB ' ' B' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 C3'-C2'-C1' 101.044 -1.183 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 mmt . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 120.889 0.376 . . . . 10.0 110.175 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 168.29 10.45 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.115 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.96 -58.22 3.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -135.95 105.19 5.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.584 HD23 ' H71' ' C' ' 4' ' ' ' DT' . 38.0 tp -78.26 143.28 37.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 10.0 110.423 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -78.63 139.41 38.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.968 0.413 . . . . 10.0 111.268 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.492 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 12.4 p90 -162.84 175.92 10.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.608 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.426 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.9 tp10 -160.13 131.14 5.73 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.8 mt -80.38 112.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.785 0.326 . . . . 10.0 110.208 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.2 mm -85.48 -39.47 13.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.657 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -165.8 127.25 1.91 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.571 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.55 142.63 37.2 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 178.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 72.2 mt -111.43 -74.47 0.64 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.559 -0.457 . . . . 10.0 111.627 -178.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 28.1 mm -129.41 144.57 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.143 0.497 . . . . 10.0 111.855 -177.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.56 126.52 65.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.462 HD21 ' HB ' ' B' ' 64' ' ' VAL . 36.0 mt -95.33 -80.57 0.41 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.704 -0.398 . . . . 10.0 111.249 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 m 175.82 -173.93 0.09 Allowed 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.378 0.671 . . . . 10.0 109.487 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.492 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -99.58 151.86 20.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.293 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.405 ' CG ' ' H ' ' A' ' 20' ' ' ALA . 14.5 t-20 -94.18 -173.33 3.06 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.405 ' H ' ' CG ' ' A' ' 19' ' ' ASN . . . -61.07 -26.4 67.61 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.639 0.733 . . . . 10.0 110.811 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -89.17 3.09 53.09 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.022 -0.99 . . . . 10.0 110.719 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.36 -1.54 88.55 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.817 -0.706 . . . . 10.0 111.466 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.492 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.2 m0 -56.13 107.05 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.987 0.366 . . . . 10.0 111.987 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 tpp85 -80.18 108.74 14.03 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.518 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 78.9 mttt -85.46 112.0 20.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.292 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -138.59 155.44 48.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.667 0.746 . . . . 10.0 112.122 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 36.4 tp -127.7 110.4 12.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.668 -1.151 . . . . 10.0 108.393 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.04 162.77 31.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.05 0.453 . . . . 10.0 111.795 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -94.84 114.72 26.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 178.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.4 m -129.54 156.74 42.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.974 0.416 . . . . 10.0 111.246 -179.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.5 p -96.83 122.3 39.65 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.04 0.447 . . . . 10.0 110.627 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.67 ' CH2' ' H73' ' C' ' 7' ' ' ' DT' . 9.2 m0 -63.92 111.23 2.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.962 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 58.93 27.97 16.95 Favored 'General case' 0 N--CA 1.463 0.179 0 O-C-N 123.806 0.691 . . . . 10.0 110.44 -178.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.1 t70 64.76 25.64 12.97 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.232 -0.895 . . . . 10.0 110.891 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.69 -80.22 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.335 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -98.32 123.74 49.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.541 0.21 . . . . 10.0 111.41 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 74.4 Cg_endo -81.05 123.86 4.72 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.997 2.464 . . . . 10.0 111.685 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -143.85 168.69 19.35 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.87 136.77 32.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.58 129.33 15.18 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.1 tt -108.73 122.62 63.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.251 0.548 . . . . 10.0 109.579 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.578 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.1 mtt85 -146.45 176.16 10.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.42 0.629 . . . . 10.0 111.977 -177.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.518 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -117.38 131.28 56.8 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 114.799 -1.091 . . . . 10.0 109.718 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.0 m0 -117.26 177.52 4.7 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.757 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -72.96 155.39 90.52 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.57 -24.07 70.19 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.195 1.93 . . . . 10.0 112.068 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -98.05 -0.86 43.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.861 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.2 m170 61.34 20.88 11.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.405 -0.816 . . . . 10.0 110.703 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -71.7 -39.34 70.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.033 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -135.35 174.3 10.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.224 0.535 . . . . 10.0 111.194 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.74 171.79 13.61 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.183 -0.917 . . . . 10.0 110.407 -177.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.712 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -137.91 -161.74 8.99 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.637 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.5 mttp -99.94 145.87 27.33 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -145.41 -121.01 1.38 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 111.08 -0.808 . . . . 10.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.425 HG21 HD11 ' A' ' 55' ' ' ILE . 12.7 tt -148.84 142.55 18.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.521 0.66 . . . . 10.0 111.14 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -101.73 136.84 40.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.833 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.4 mt -117.09 120.48 38.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.925 0.393 . . . . 10.0 110.27 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.465 ' HB3' ' HG2' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -80.6 172.49 13.69 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.502 179.586 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -58.22 -43.05 87.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 10.0 111.503 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.528 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.2 pt-20 -54.44 -47.38 72.95 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.39 0.614 . . . . 10.0 110.509 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.528 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 26.7 mt-10 -68.23 -58.64 4.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.052 -0.977 . . . . 10.0 111.326 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.698 ' CE2' HD11 ' A' ' 66' ' ' LEU . 10.1 t80 -49.82 -44.83 49.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.401 -0.818 . . . . 10.0 111.867 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.87 -58.5 13.42 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.229 -0.51 . . . . 10.0 113.181 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -65.17 -40.93 90.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.883 0.373 . . . . 10.0 111.296 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.459 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.1 tp -58.24 -53.84 53.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.958 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.698 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.1 mt -61.92 -43.84 98.01 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.106 -0.237 . . . . 10.0 111.356 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.1 tttm -50.76 -53.31 32.75 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 123.616 0.572 . . . . 10.0 111.07 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 25.2 mm-40 -72.07 -44.56 63.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.706 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 44.0 mt -59.43 -44.0 92.98 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.424 0.157 . . . . 10.0 111.424 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.4 94.67 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.459 -0.876 . . . . 10.0 110.987 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.75 -28.15 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.702 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 72.3 mmtt -68.54 -30.7 69.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.285 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.4 mt -88.49 2.56 52.62 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.243 -0.183 . . . . 10.0 111.419 -179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.471 -0.776 . . . . 10.0 110.309 179.857 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.3 mmt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.915 0.388 . . . . 10.0 110.18 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.24 163.47 13.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.322 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.404 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 4.6 t70 -66.32 -60.37 2.83 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.404 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 35.1 mmtm -132.5 104.64 6.79 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.522 HD21 ' H72' ' C' ' 14' ' ' ' DT' . 37.3 tp -77.56 142.71 38.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.814 0.34 . . . . 10.0 110.692 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -79.36 136.27 36.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.078 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.589 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.3 p90 -160.11 174.77 13.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.681 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.436 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 13.5 tp10 -158.64 126.57 5.14 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.059 -0.348 . . . . 10.0 110.059 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 71.9 mt -76.0 114.55 16.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.064 0.459 . . . . 10.0 110.156 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 32.0 mm -86.99 -41.26 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.428 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -164.48 127.53 2.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.771 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -76.52 142.89 40.72 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.4 mt -111.75 -72.55 0.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.521 -0.472 . . . . 10.0 111.861 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.434 HD11 ' CB ' ' A' ' 68' ' ' GLU . 21.5 mm -131.5 144.2 38.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 10.0 111.496 -177.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -129.16 123.36 58.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 177.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 26.5 mt -92.3 -80.81 0.36 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.905 -0.318 . . . . 10.0 111.445 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 176.59 -172.05 0.09 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.302 0.641 . . . . 10.0 109.386 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.448 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.9 mp0 -101.34 150.87 22.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . 0.434 ' CG ' ' H ' ' B' ' 20' ' ' ALA . 18.0 t-20 -90.91 -174.51 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.781 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . 0.434 ' H ' ' CG ' ' B' ' 19' ' ' ASN . . . -63.82 -23.83 67.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.453 0.644 . . . . 10.0 110.596 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . 0.44 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 24.6 mttt -91.06 1.49 57.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.287 -0.869 . . . . 10.0 110.314 179.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.34 -1.21 87.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.389 -178.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.5 ' HB3' ' CG2' ' B' ' 43' ' ' THR . 40.3 m0 -56.68 107.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.61 109.58 15.27 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . 0.424 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 80.8 mttt -86.36 111.58 20.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.611 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.21 157.14 46.88 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.568 0.699 . . . . 10.0 112.138 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 35.4 tp -128.88 111.02 12.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.742 -1.117 . . . . 10.0 108.192 178.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -135.57 161.03 36.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.037 0.446 . . . . 10.0 111.435 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 ttm-85 -93.03 114.67 27.29 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.35 -0.981 . . . . 10.0 108.35 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 18.3 m -128.87 154.99 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.948 0.404 . . . . 10.0 111.076 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.5 p -95.63 122.72 38.69 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.972 0.415 . . . . 10.0 110.513 179.226 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -63.99 112.39 2.93 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.82 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 57.58 28.13 15.18 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.708 0.63 . . . . 10.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 62.95 30.45 16.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.963 -1.017 . . . . 10.0 110.884 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.77 -79.07 0.58 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.102 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.485 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 35.6 tt0 -99.05 122.06 53.66 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.532 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 65.7 Cg_endo -79.78 122.52 4.94 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.716 2.277 . . . . 10.0 111.709 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -142.99 166.57 24.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -87.41 135.65 33.25 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.5 t0 -147.41 128.57 14.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 10.1 tt -107.34 123.25 62.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.494 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.0 mtt85 -146.23 175.05 10.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.494 0.664 . . . . 10.0 112.119 -177.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.5 ' CG2' ' HB3' ' B' ' 23' ' ' TRP . 0.0 OUTLIER -117.45 131.59 56.71 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.728 -1.124 . . . . 10.0 109.887 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 18.0 m0 -117.56 177.99 4.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.56 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.9 m -74.21 155.44 88.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.17 -31.21 89.87 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.073 1.849 . . . . 10.0 112.145 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.14 -3.8 57.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.195 179.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 m170 64.15 24.7 13.52 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.489 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.68 -39.64 61.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.138 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -133.97 174.3 10.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.136 0.493 . . . . 10.0 110.834 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.74 168.82 18.94 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.573 -177.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.631 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -135.04 -163.79 10.23 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.704 -0.76 . . . . 10.0 112.664 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mttp -98.59 144.84 27.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.38 0.511 . . . . 10.0 112.38 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.52 -118.54 1.31 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.8 tt -152.56 142.35 14.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.413 0.607 . . . . 10.0 110.919 179.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.6 m -102.44 135.42 44.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.475 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 68.8 mt -115.75 121.23 41.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.871 0.367 . . . . 10.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.9 m -80.45 174.01 12.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.582 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -59.26 -40.78 87.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.838 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.508 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 8.5 pt-20 -55.55 -46.67 77.11 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.606 0.717 . . . . 10.0 110.432 178.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.508 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 31.6 mt-10 -68.54 -58.62 4.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.021 -0.991 . . . . 10.0 111.202 -179.226 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.4 ' CE2' HD13 ' B' ' 66' ' ' LEU . 1.0 OUTLIER -53.83 -39.18 65.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.822 -178.529 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.32 -59.65 9.59 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.918 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.462 ' HB ' HD21 ' A' ' 16' ' ' LEU . 8.9 t -67.19 -41.04 86.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.627 0.251 . . . . 10.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.58 -53.59 56.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.094 -179.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.4 HD13 ' CE2' ' B' ' 62' ' ' PHE . 45.3 mt -59.01 -49.12 79.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.238 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -50.19 -54.19 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.662 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 21.7 mm-40 -69.38 -46.53 66.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.856 -0.611 . . . . 10.0 112.056 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.445 ' HB3' HD23 ' A' ' 66' ' ' LEU . 46.8 mt -60.57 -43.86 96.82 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.127 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.04 94.11 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.717 -0.953 . . . . 10.0 110.717 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.19 -23.6 61.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.365 -0.418 . . . . 10.0 111.185 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.6 mmtt -70.06 -29.82 66.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.185 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 21.5 mt -90.31 4.52 50.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.563 0.22 . . . . 10.0 111.411 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.907 -0.568 . . . . 10.0 109.866 179.071 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 C3'-C2'-C1' 101.449 -0.894 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . 0.512 ' H73' ' O ' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 101.404 -0.926 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.431 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.956 0 O4'-C1'-C2' 104.182 -1.744 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.712 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C4'-C3' 103.508 -2.092 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.578 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.899 0 O4'-C4'-C3' 103.56 -2.04 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.769 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.822 0 C5'-C4'-O4' 112.945 2.216 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.67 ' H73' ' CH2' ' A' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.425 -0.932 0 C3'-C2'-C1' 101.373 -0.948 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . 0.44 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 101.282 -1.013 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 C3'-C2'-C1' 101.832 -0.62 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.449 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.924 0 O4'-C1'-C2' 104.352 -1.589 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.631 " H1'" ' O ' ' B' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C4'-C3' 103.502 -2.098 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.494 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.421 -1.158 0 O4'-C4'-C3' 103.706 -1.894 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.793 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.829 0 C5'-C4'-O4' 113.039 2.274 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.485 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 C3'-C2'-C1' 100.941 -1.257 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.431 ' H3 ' ' P ' ' C' ' 5' ' ' ' DT' . 49.6 mmm . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 120.869 0.366 . . . . 10.0 110.228 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.44 154.68 18.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.903 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.467 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 24.3 t70 -60.15 -52.8 63.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.124 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.467 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 24.4 mmtm -137.8 106.41 5.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.859 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.571 HD21 ' H71' ' C' ' 4' ' ' ' DT' . 31.0 tp -82.93 137.3 34.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.081 -0.34 . . . . 10.0 110.081 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -73.23 134.52 44.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.279 -0.418 . . . . 10.0 110.889 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -159.83 168.29 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.257 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.501 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.5 tp10 -147.49 135.22 21.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.145 178.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.68 106.69 14.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.433 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.414 HG13 ' HB3' ' A' ' 37' ' ' PRO . 37.2 mm -77.11 -56.51 7.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.937 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -157.83 126.79 5.71 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.062 -179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -73.46 142.61 46.85 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.1 mt -110.69 -75.65 0.62 Allowed 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.368 -0.533 . . . . 10.0 111.539 -178.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.447 HD13 ' O ' ' A' ' 13' ' ' LEU . 29.9 mm -131.03 136.95 56.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.162 0.506 . . . . 10.0 111.741 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -117.23 123.18 71.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.246 -1.02 . . . . 10.0 108.246 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -90.45 -80.87 0.32 Allowed 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.764 -0.374 . . . . 10.0 111.308 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.3 m 176.59 -179.13 0.17 Allowed 'General case' 0 C--O 1.235 0.34 0 C-N-CA 122.952 0.501 . . . . 10.0 110.006 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 45.1 mp0 -95.09 164.46 12.86 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.02 -167.69 1.25 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.307 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.49 ' O ' ' H71' ' C' ' 1' ' ' ' DT' . . . -62.48 -25.71 68.14 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 10.0 110.556 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -91.56 0.24 57.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.146 -0.933 . . . . 10.0 110.728 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 -1.56 88.57 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.811 -0.709 . . . . 10.0 111.492 -178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.508 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.0 m0 -53.05 105.64 0.13 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.558 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.0 tpp85 -80.37 100.16 8.3 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 178.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -81.57 112.02 18.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.675 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -137.98 152.4 48.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.372 0.606 . . . . 10.0 111.58 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.517 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 34.2 tp -122.99 107.65 12.05 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -134.28 157.76 45.5 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.478 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -97.12 114.32 25.99 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.7 m -125.41 162.04 28.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.795 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.501 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -98.78 123.97 43.36 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.95 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -64.28 112.28 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.982 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.6 m-80 58.72 28.93 17.96 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.681 0.613 . . . . 10.0 110.447 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.7 t70 64.23 27.69 13.91 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.128 -0.942 . . . . 10.0 110.648 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.47 -82.61 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.366 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -89.19 120.5 69.82 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.556 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 33.8 Cg_endo -82.93 120.64 3.06 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.664 2.243 . . . . 10.0 111.111 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.424 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 16.3 ttpt -148.19 160.73 42.63 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.216 -0.29 . . . . 10.0 110.216 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -81.63 140.0 34.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.628 -0.26 . . . . 10.0 110.692 -178.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.405 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -150.4 133.9 16.49 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 10.6 tt -111.86 122.75 66.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.118 0.485 . . . . 10.0 109.92 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.55 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.4 mtt85 -148.14 171.19 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.495 -177.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.558 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.7 p -121.31 134.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -118.76 177.97 4.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.541 0.21 . . . . 10.0 110.872 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.7 m -63.38 151.81 86.59 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.837 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.04 -30.73 83.27 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.528 2.152 . . . . 10.0 111.88 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -91.11 -3.03 57.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.253 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 64.25 24.83 13.44 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.716 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.37 -34.05 61.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.008 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -141.33 174.45 10.53 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.347 0.594 . . . . 10.0 111.722 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.93 172.62 10.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.761 -1.109 . . . . 10.0 110.944 -178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.633 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -140.58 -171.71 12.6 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 121.062 -0.59 . . . . 10.0 112.475 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.8 mttp -99.0 144.33 28.28 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 121.979 -0.718 . . . . 10.0 112.446 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.59 -120.38 1.47 Allowed Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.577 -1.009 . . . . 10.0 110.577 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -149.18 142.65 18.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 117.513 0.656 . . . . 10.0 110.818 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.613 ' HB ' ' H72' ' C' ' 7' ' ' ' DT' . 2.2 m -97.47 139.79 32.88 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.973 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.7 mt -115.8 118.77 33.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.913 0.387 . . . . 10.0 110.594 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -77.5 167.28 21.91 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.8 -39.88 86.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.779 0.323 . . . . 10.0 110.399 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 61' ' ' GLU . 6.7 pt-20 -56.63 -46.93 80.68 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.253 178.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.411 ' H ' ' HG3' ' A' ' 60' ' ' GLU . 31.5 mt-10 -67.81 -56.37 9.42 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.786 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.667 ' CE2' HD11 ' A' ' 66' ' ' LEU . 7.8 t80 -49.72 -47.95 50.29 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.029 0.831 . . . . 10.0 111.776 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.94 -56.46 25.19 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.39 -0.433 . . . . 10.0 113.382 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.1 t -67.28 -42.33 87.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.82 0.343 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 17.5 tp -58.53 -53.38 58.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.016 -178.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.667 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.2 mt -61.26 -44.41 97.28 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.38 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.7 tttm -52.19 -53.49 42.69 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.046 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.609 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 54.5 mm-40 -70.09 -47.88 59.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.702 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.492 ' HB3' HD21 ' B' ' 66' ' ' LEU . 59.0 mt -58.27 -45.46 87.83 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.633 0.234 . . . . 10.0 111.633 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.3 -35.04 91.46 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.565 -0.826 . . . . 10.0 111.396 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -73.48 -28.72 62.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.491 -0.354 . . . . 10.0 110.859 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.609 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 52.1 mmtt -68.88 -23.4 64.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.986 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.3 mt -89.86 -14.35 34.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.868 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.851 -0.595 . . . . 10.0 110.462 -179.642 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.469 ' H3 ' ' P ' ' C' ' 15' ' ' ' DT' . 31.9 mmm . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.689 0.28 . . . . 10.0 110.605 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.72 161.04 13.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.431 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 23.2 t70 -66.79 -52.73 40.54 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 31.6 mmtm -136.98 104.95 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.031 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.535 HD21 ' H72' ' C' ' 14' ' ' ' DT' . 37.4 tp -82.18 133.67 35.27 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.452 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.8 tppt? -72.47 133.14 44.69 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.072 0.463 . . . . 10.0 111.282 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.512 ' CD1' ' H71' ' C' ' 14' ' ' ' DT' . 8.2 p90 -158.35 170.02 23.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.554 179.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . 0.474 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.0 tp10 -147.32 133.64 19.55 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 50.9 mt -81.63 105.0 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.98 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 47.3 mm -75.34 -56.93 7.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.071 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -157.58 130.33 7.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.981 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.92 141.31 40.56 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.922 -0.77 . . . . 10.0 108.922 178.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 44.0 mt -110.27 -74.09 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.439 -0.504 . . . . 10.0 111.664 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 19.5 mm -130.29 136.79 57.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.046 0.45 . . . . 10.0 111.714 -177.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.456 HG21 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -118.48 120.45 64.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -87.43 -81.15 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.719 -0.392 . . . . 10.0 111.41 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m 176.07 -177.99 0.13 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.017 0.527 . . . . 10.0 109.922 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 36.7 mp0 -96.81 163.92 12.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.15 -166.61 1.13 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.461 -0.2 . . . . 10.0 110.461 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.85 -26.76 68.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.388 0.613 . . . . 10.0 110.89 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -92.04 0.41 57.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.322 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.51 -0.23 89.7 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.632 -0.794 . . . . 10.0 111.666 -178.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' TRP . . . . . 0.513 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -52.72 106.28 0.15 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 112.03 0.382 . . . . 10.0 112.03 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.3 tpp85 -80.59 100.25 8.52 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -81.59 112.19 18.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.755 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . 0.456 ' HG2' HG21 ' B' ' 15' ' ' VAL . 53.8 mt-10 -138.21 152.94 49.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.387 0.613 . . . . 10.0 111.811 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.475 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 36.8 tp -123.08 107.56 11.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.008 -1.108 . . . . 10.0 108.008 178.278 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -134.45 157.28 46.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.565 -0.289 . . . . 10.0 110.714 -178.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -96.67 114.97 26.66 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 19.4 m -126.69 160.99 34.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.665 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.474 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -97.28 124.54 41.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.079 0.466 . . . . 10.0 111.094 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' TRP . . . . . 0.631 ' CH2' ' H72' ' C' ' 17' ' ' ' DT' . 11.5 m0 -64.46 111.75 2.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.008 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.452 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.4 m-80 58.4 30.63 19.9 Favored 'General case' 0 CA--C 1.521 -0.139 0 O-C-N 123.802 0.689 . . . . 10.0 110.361 -178.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.4 t0 61.0 33.01 19.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.986 -1.006 . . . . 10.0 110.565 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.46 -78.72 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.923 -0.58 . . . . 10.0 111.289 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -92.41 117.55 67.68 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.432 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.4 Cg_endo -81.0 119.98 3.67 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.592 2.195 . . . . 10.0 111.279 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ttpt -148.36 161.62 41.2 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.035 -0.266 . . . . 10.0 110.436 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -81.17 139.53 35.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.876 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.404 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -150.71 132.61 15.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' ILE . . . . . 0.431 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.8 tt -110.25 122.87 65.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-O 121.246 0.546 . . . . 10.0 110.193 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.499 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.1 mtt85 -147.88 170.58 17.35 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.661 -177.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.5 p -120.53 134.17 55.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m0 -118.03 177.75 4.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.789 -0.187 . . . . 10.0 110.973 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -66.11 151.04 96.15 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.675 -0.239 . . . . 10.0 110.372 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.61 -33.34 96.81 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.569 2.18 . . . . 10.0 111.793 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -87.15 -5.03 59.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.289 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 66.48 21.0 10.87 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.586 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -70.49 -37.87 74.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.956 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -137.79 174.17 10.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.495 0.664 . . . . 10.0 112.293 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.58 172.09 11.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.743 -1.117 . . . . 10.0 110.72 -178.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . 0.582 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -140.14 -170.18 11.92 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 121.034 -0.603 . . . . 10.0 112.248 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -99.7 142.2 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.987 -0.714 . . . . 10.0 112.53 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -140.01 -120.64 1.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 110.209 -1.156 . . . . 10.0 110.209 179.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.3 tt -150.06 143.26 17.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.413 0.607 . . . . 10.0 110.565 179.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m -97.0 140.0 32.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.271 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -116.5 117.71 30.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.845 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -76.22 166.67 23.13 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.22 -39.24 85.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 10.0 110.166 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' B' ' 61' ' ' GLU . 7.0 pt-20 -56.88 -44.98 82.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.44 -0.8 . . . . 10.0 110.381 177.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' B' ' 60' ' ' GLU . 33.8 mt-10 -69.63 -56.37 7.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.454 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.54 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.2 t80 -52.25 -44.5 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.82 0.7 . . . . 10.0 111.332 -179.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.81 -55.44 30.85 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.907 -0.663 . . . . 10.0 113.128 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.8 t -68.99 -44.18 81.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.895 0.378 . . . . 10.0 111.228 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.25 -52.45 65.27 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.007 -178.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 29.8 mt -59.03 -50.75 72.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.775 0.322 . . . . 10.0 110.742 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -50.08 -55.33 15.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.934 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 40.6 mm-40 -67.95 -49.67 60.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.983 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.413 ' HB3' HD21 ' A' ' 66' ' ' LEU . 64.7 mt -58.86 -45.4 90.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.613 0.227 . . . . 10.0 111.613 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.64 -36.72 93.65 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.616 -0.802 . . . . 10.0 111.15 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -73.59 -28.02 61.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.938 0.399 . . . . 10.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.4 mmtt -66.81 -25.93 66.69 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.87 0.367 . . . . 10.0 110.689 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 21.5 mt -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.313 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.77 -0.633 . . . . 10.0 110.205 179.739 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 1' ' ' ' DT' . . . . . 0.49 ' H71' ' O ' ' A' ' 20' ' ' ALA . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 O5'-C5'-C4' 109.235 -0.69 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 101.368 -0.952 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.942 0 O4'-C1'-C2' 104.15 -1.772 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.658 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.519 -0.877 0 O4'-C4'-C3' 103.507 -2.093 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.55 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.92 0 O4'-C4'-C3' 103.56 -2.04 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.772 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.749 0 C5'-C4'-O4' 113.042 2.276 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.613 ' H72' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 101.184 -1.083 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C3'-C2'-C1' 101.373 -0.948 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 12' ' ' ' DT' . . . . . 0.444 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 101.665 -0.739 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 13' ' ' ' DT' . . . . . 0.444 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.818 0 O4'-C1'-C2' 104.419 -1.528 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.585 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 O4'-C4'-C3' 103.457 -2.143 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.499 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 O4'-C4'-C3' 103.63 -1.97 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.76 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.732 0 C5'-C4'-O4' 113.114 2.321 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . 0.631 ' H72' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.425 -0.937 0 C3'-C2'-C1' 101.153 -1.105 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.8 mmm . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 121.001 0.429 . . . . 10.0 110.084 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.06 160.16 25.91 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.383 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -64.16 -49.41 72.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 10.0 110.25 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -134.55 108.32 8.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.098 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.6 tp -82.77 134.7 35.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.095 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -70.31 139.18 52.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.93 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 p90 -166.57 175.08 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.488 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -158.51 134.01 8.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.628 ' HA ' HG12 ' A' ' 30' ' ' VAL . 52.2 mt -80.79 111.82 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.9 mm -83.4 -45.96 18.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.591 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -159.31 132.43 7.04 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.107 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.0 127.44 33.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 75.9 mt -99.99 -74.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.474 -0.49 . . . . 10.0 111.931 -178.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.638 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.2 mm -130.09 144.16 38.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.086 0.469 . . . . 10.0 112.212 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.487 HG23 ' HG2' ' A' ' 26' ' ' GLU . 4.3 p -124.48 123.86 67.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.324 -0.991 . . . . 10.0 108.324 177.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.2 mt -91.02 -80.36 0.34 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.366 -0.534 . . . . 10.0 111.046 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 175.51 -177.42 0.11 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.086 0.554 . . . . 10.0 109.782 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.488 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 36.4 mp0 -97.26 164.08 12.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.38 -166.4 1.08 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -29.23 70.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.395 0.617 . . . . 10.0 109.874 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -87.91 -1.84 58.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.21 -0.905 . . . . 10.0 110.309 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.64 0.15 89.23 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.672 -0.775 . . . . 10.0 112.041 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.488 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.6 m0 -52.95 107.07 0.19 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 122.493 0.317 . . . . 10.0 111.794 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 43' ' ' THR . 14.7 tpp85 -79.97 100.28 8.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -82.59 112.75 19.76 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.751 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG2' HG23 ' A' ' 15' ' ' VAL . 45.6 mt-10 -139.25 161.67 36.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.638 0.733 . . . . 10.0 111.975 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.775 HD13 ' HB ' ' A' ' 41' ' ' ILE . 35.3 tp -130.37 108.07 9.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.569 -1.196 . . . . 10.0 108.521 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -135.62 157.38 47.01 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.832 0.349 . . . . 10.0 110.508 -178.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 29' ' ' ARG . 8.6 ttp180 -97.51 114.66 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.628 HG12 ' HA ' ' A' ' 9' ' ' ILE . 23.9 m -124.69 162.16 27.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.769 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 2.4 p -95.31 122.23 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.925 0.393 . . . . 10.0 110.635 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.1 m0 -63.86 109.46 1.76 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.768 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 60.11 29.55 19.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.931 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 t0 61.63 35.11 17.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.803 -1.09 . . . . 10.0 110.715 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.64 -76.8 0.58 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.01 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -92.48 116.16 66.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 61.3 Cg_endo -81.63 120.6 3.56 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.514 2.143 . . . . 10.0 111.049 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -149.88 159.55 44.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.686 0.279 . . . . 10.0 110.48 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.505 ' HD1' HD11 ' A' ' 13' ' ' LEU . 1.0 OUTLIER -78.68 133.95 37.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.895 -179.347 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -144.43 129.01 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.775 ' HB ' HD13 ' A' ' 27' ' ' LEU . 12.8 tt -106.13 122.44 59.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.289 0.566 . . . . 10.0 110.486 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.46 ' CZ ' ' H ' ' A' ' 54' ' ' GLY . 2.8 mtp85 -149.14 174.27 12.52 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.252 -178.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.565 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.8 p -124.19 138.44 54.41 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.625 -0.879 . . . . 10.0 108.625 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -117.89 176.92 4.98 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 121.081 -0.248 . . . . 10.0 110.987 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -66.13 150.7 96.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.365 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.04 -38.16 96.59 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.91 2.407 . . . . 10.0 112.65 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -88.11 5.7 39.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.893 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 57.86 28.05 15.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.277 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -81.03 -31.91 34.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.451 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -140.71 174.79 10.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 10.0 111.587 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.79 172.59 10.69 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.012 -0.994 . . . . 10.0 110.929 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.35 -170.26 11.81 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.734 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.431 ' HA ' ' NH2' ' A' ' 42' ' ' ARG . 22.4 mttp -103.62 141.77 35.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 10.0 112.301 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.46 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -141.0 -117.46 1.37 Allowed Glycine 0 N--CA 1.453 -0.192 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -152.78 142.12 14.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 117.381 0.591 . . . . 10.0 110.976 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 m -96.77 135.13 39.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.333 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 65.3 mt -115.02 117.44 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -78.58 169.96 17.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.567 -0.288 . . . . 10.0 110.558 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -57.38 -44.86 84.78 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.164 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.457 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 7.4 pt-20 -54.97 -45.04 74.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.854 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.457 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 34.8 mt-10 -69.26 -59.77 2.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.008 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.647 ' CE2' HD11 ' A' ' 66' ' ' LEU . 3.5 t80 -52.32 -42.15 63.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.73 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.68 -59.68 10.33 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.233 -0.508 . . . . 10.0 112.648 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 72.3 t -64.63 -41.28 91.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.99 0.424 . . . . 10.0 110.604 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.528 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.1 tp -57.67 -54.24 49.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.807 -179.426 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.704 ' HB3' HD11 ' B' ' 73' ' ' LEU . 17.2 mt -62.37 -43.24 99.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.702 -0.226 . . . . 10.0 111.464 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -53.43 -50.77 64.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.196 0.522 . . . . 10.0 110.733 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.625 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 41.8 mm-40 -71.5 -48.82 46.53 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.384 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.8 mt -57.37 -45.45 84.43 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.742 0.275 . . . . 10.0 111.742 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.69 -38.06 95.28 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 111.322 -0.711 . . . . 10.0 111.322 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -73.51 -25.21 60.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.869 0.366 . . . . 10.0 110.758 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.625 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.82 -29.02 68.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.883 0.373 . . . . 10.0 110.685 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.648 HD11 ' HB3' ' B' ' 66' ' ' LEU . 36.9 mt -87.72 3.14 49.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.146 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 C--O 1.252 1.184 0 CA-C-O 118.607 -0.711 . . . . 10.0 109.998 179.495 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mmm . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.916 0.389 . . . . 10.0 110.58 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.44 161.22 16.38 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.487 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.528 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 26.7 t70 -64.13 -50.26 68.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.183 0.516 . . . . 10.0 109.754 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.528 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 40.7 mmtm -135.02 109.88 8.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.672 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -83.88 135.82 34.35 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.992 -0.373 . . . . 10.0 109.992 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.405 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.2 tppt? -71.34 137.37 48.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.161 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -164.59 177.25 8.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.256 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -159.88 131.97 6.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.521 ' HA ' HG12 ' B' ' 30' ' ' VAL . 51.4 mt -78.37 108.87 12.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 10.0 110.697 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.3 mm -80.02 -50.23 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.139 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -156.51 130.75 8.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.949 -0.568 . . . . 10.0 111.237 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.08 132.14 35.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.506 HD11 ' HD1' ' B' ' 39' ' ' TYR . 57.4 mt -103.87 -71.42 0.73 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.648 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.562 HD12 ' CB ' ' A' ' 68' ' ' GLU . 19.8 mm -131.8 142.37 43.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.978 0.418 . . . . 10.0 111.946 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.431 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.8 p -124.26 121.51 61.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.277 -1.009 . . . . 10.0 108.277 177.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 37.0 mt -88.24 -80.54 0.27 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.615 -0.434 . . . . 10.0 111.489 -178.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 175.25 -178.01 0.11 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.487 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 35.3 mp0 -97.15 163.76 12.79 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.77 -164.01 0.89 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.921 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.33 -23.57 64.72 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.294 0.568 . . . . 10.0 110.3 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -93.8 -0.35 55.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.937 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.39 0.03 89.36 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.829 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.487 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.5 m0 -53.59 107.62 0.27 Allowed 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.56 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.1 tpp85 -80.46 100.2 8.39 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.284 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -81.5 113.19 19.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.857 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.431 ' HG2' HG23 ' B' ' 15' ' ' VAL . 50.5 mt-10 -139.74 162.03 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.519 0.676 . . . . 10.0 112.037 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.757 HD13 ' HB ' ' B' ' 41' ' ' ILE . 32.8 tp -131.76 107.14 8.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.725 -1.125 . . . . 10.0 108.517 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -135.5 155.95 49.68 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.634 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -96.18 114.53 26.24 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' B' ' 9' ' ' ILE . 17.0 m -122.91 162.19 23.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.443 -179.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.0 p -94.97 121.96 37.13 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.949 0.404 . . . . 10.0 110.373 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -63.63 109.92 1.84 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.661 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.405 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.9 m-80 60.54 28.14 17.81 Favored 'General case' 0 N--CA 1.462 0.14 0 O-C-N 123.781 0.676 . . . . 10.0 110.115 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.0 t70 65.91 25.29 11.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.585 -1.189 . . . . 10.0 110.982 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.74 -78.41 0.58 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.13 -0.356 . . . . 10.0 111.916 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -87.48 117.17 68.2 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.775 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 58.9 Cg_endo -82.82 119.45 2.91 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.143 1.896 . . . . 10.0 110.971 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.455 ' HE3' HG21 ' B' ' 56' ' ' THR . 12.3 ttpt -148.51 158.38 44.08 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 121.01 -0.276 . . . . 10.0 110.471 -178.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' TYR . . . . . 0.506 ' HD1' HD11 ' B' ' 13' ' ' LEU . 1.2 m-85 -78.6 133.08 37.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.457 -179.245 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -143.72 129.25 19.09 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.757 ' HB ' HD13 ' B' ' 27' ' ' LEU . 12.1 tt -106.67 122.5 60.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.287 0.565 . . . . 10.0 110.525 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.431 ' NH2' ' HA ' ' B' ' 53' ' ' LYS . 3.2 mtp85 -149.23 175.07 11.71 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.332 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.56 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.4 p -125.17 138.3 54.14 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.8 m-90 -117.88 176.87 5.0 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.921 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.8 m -64.99 150.79 94.76 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.581 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.39 -42.27 69.93 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.788 2.325 . . . . 10.0 112.408 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -88.36 11.75 15.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.117 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 53.48 33.35 15.89 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.563 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -84.02 -32.79 24.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.371 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -141.32 174.31 10.66 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.325 0.584 . . . . 10.0 111.351 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.27 173.05 9.58 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.711 -1.131 . . . . 10.0 110.646 -178.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.72 -169.21 11.56 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.979 -0.629 . . . . 10.0 112.578 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' LYS . . . . . 0.431 ' HA ' ' NH2' ' B' ' 42' ' ' ARG . 18.3 mttp -102.26 144.59 30.58 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.237 0.541 . . . . 10.0 112.033 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -144.18 -120.25 1.41 Allowed Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 110.73 -0.948 . . . . 10.0 110.73 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -151.65 142.38 15.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 117.309 0.555 . . . . 10.0 110.603 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.455 HG21 ' HE3' ' B' ' 38' ' ' LYS . 2.5 m -96.55 136.09 37.54 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.648 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.83 117.53 30.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.324 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.65 171.18 15.51 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.664 -0.243 . . . . 10.0 110.534 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -58.39 -44.83 89.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.98 0.419 . . . . 10.0 110.323 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.456 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.4 pt-20 -55.13 -45.03 75.58 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.894 178.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.456 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 33.5 mt-10 -70.25 -60.52 2.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.936 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.527 ' CE2' HD11 ' B' ' 66' ' ' LEU . 1.6 t80 -52.83 -38.27 61.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.658 -0.701 . . . . 10.0 111.553 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.96 -57.9 16.41 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.157 -0.544 . . . . 10.0 112.616 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 43.4 t -66.76 -40.07 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.442 . . . . 10.0 110.423 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.0 tp -58.21 -53.18 61.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.604 -0.725 . . . . 10.0 111.03 -179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.648 ' HB3' HD11 ' A' ' 73' ' ' LEU . 55.9 mt -60.3 -49.89 75.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.273 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.7 tttm -50.78 -51.58 49.16 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.464 0.477 . . . . 10.0 111.657 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.638 ' HB3' HD12 ' A' ' 14' ' ' ILE . 21.9 mm-40 -70.41 -49.2 51.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.71 -179.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.604 ' HB3' HD22 ' A' ' 66' ' ' LEU . 60.8 mt -59.81 -42.74 94.15 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.49 -39.4 97.78 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -72.88 -25.44 61.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.065 0.459 . . . . 10.0 111.037 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.6 mmtt -66.44 -29.67 69.86 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.997 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.704 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.1 mt -90.97 5.15 49.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.999 -0.28 . . . . 10.0 111.395 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 . . . . . 0 C--O 1.25 1.102 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 178.117 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.971 0.415 . . . . 10.0 110.653 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -111.11 173.22 6.44 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.56 -54.95 8.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -137.41 104.18 5.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.846 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.8 tp -73.46 145.97 45.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.164 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -76.12 131.53 39.47 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.055 0.455 . . . . 10.0 110.583 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.1 p90 -156.16 166.52 33.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.808 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.518 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.5 tp10 -150.95 124.35 8.92 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.505 -0.554 . . . . 10.0 109.505 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.2 mt -75.67 110.23 10.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.031 0.443 . . . . 10.0 110.106 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.5 mm -80.92 -43.34 20.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.43 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -164.22 128.13 2.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.972 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -76.45 135.22 39.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.587 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 95.9 mt -105.93 -74.84 0.64 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.78 -0.368 . . . . 10.0 111.809 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.665 HD12 ' HB3' ' B' ' 68' ' ' GLU . 23.8 mm -132.71 138.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.338 0.59 . . . . 10.0 112.318 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.01 119.8 59.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 107.693 -1.225 . . . . 10.0 107.693 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.491 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.7 mt -88.85 -80.85 0.28 Allowed 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.382 -0.527 . . . . 10.0 111.816 -178.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -175.67 -171.94 0.5 Allowed 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.443 -0.577 . . . . 10.0 109.443 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.7 mp0 -105.47 140.92 37.84 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -79.21 -170.78 2.4 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -26.03 68.27 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.566 0.698 . . . . 10.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.9 mttt -91.28 4.55 52.06 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.028 -0.987 . . . . 10.0 110.921 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.22 7.27 87.95 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.454 -0.879 . . . . 10.0 110.98 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -62.14 101.4 0.22 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 10.0 111.416 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.414 ' HG3' ' HG3' ' A' ' 26' ' ' GLU . 16.7 tpp85 -81.48 103.25 11.09 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.932 -0.577 . . . . 10.0 109.671 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -86.5 113.29 22.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.798 0.333 . . . . 10.0 110.153 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.414 ' HG3' ' HG3' ' A' ' 24' ' ' ARG . 61.4 mt-10 -129.93 146.94 51.64 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.353 0.597 . . . . 10.0 111.464 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.587 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 26.3 tp -114.05 108.0 16.42 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.716 -1.216 . . . . 10.0 107.716 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -134.44 152.95 52.11 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.944 0.402 . . . . 10.0 111.27 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -86.67 114.65 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.77 158.3 41.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.941 0.401 . . . . 10.0 110.828 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.518 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.9 p -97.13 125.05 41.36 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.629 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.6 m0 -64.49 108.04 1.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.652 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.3 m-80 60.03 29.06 18.66 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 123.776 0.672 . . . . 10.0 110.488 -178.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.4 t70 66.75 18.0 10.64 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.928 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.6 -79.15 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.988 -0.445 . . . . 10.0 111.918 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -97.19 124.92 47.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -178.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.3 Cg_endo -83.85 121.81 2.91 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 123.017 2.478 . . . . 10.0 111.874 178.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.585 ' HD2' HG22 ' A' ' 56' ' ' THR . 13.8 ttmm -143.98 167.24 22.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -88.42 133.54 34.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.503 0.192 . . . . 10.0 110.746 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.499 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -146.89 130.09 16.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.467 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.6 tt -104.56 122.9 58.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.499 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.2 mtt85 -142.04 -178.38 5.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -177.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -113.44 142.17 46.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.962 -1.017 . . . . 10.0 112.02 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -123.7 164.3 19.39 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.48 -0.782 . . . . 10.0 109.007 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.2 p -78.37 158.89 76.01 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.27 -20.91 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.431 2.087 . . . . 10.0 112.283 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.28 0.53 25.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.177 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 56.26 37.01 28.43 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.647 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -90.62 -39.73 12.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.274 0.559 . . . . 10.0 109.975 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -134.04 174.64 10.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.344 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -147.88 172.94 13.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.963 -177.544 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.6 -162.17 10.91 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.319 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -98.9 152.13 20.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.671 . . . . 10.0 111.694 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -140.98 -122.32 1.85 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.326 -0.71 . . . . 10.0 111.326 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.9 tt -151.65 140.84 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.265 0.555 . . . . 10.0 111.154 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.585 HG22 ' HD2' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -99.79 144.3 29.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.17 -179.894 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.84 128.62 47.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.17 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.19 163.9 26.13 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.924 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -55.6 -48.51 74.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.854 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.32 -47.64 83.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 10.0 111.076 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -61.04 -45.39 94.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.67 ' CE2' HD11 ' A' ' 66' ' ' LEU . 26.9 t80 -60.94 -45.19 95.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.268 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.33 -52.22 53.98 Favored Glycine 0 N--CA 1.451 -0.3 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.722 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.4 t -62.25 -42.27 94.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.877 0.37 . . . . 10.0 110.478 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -58.12 -54.4 47.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.794 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.67 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -63.39 -43.09 98.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.15 -0.22 . . . . 10.0 111.578 -179.137 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.0 tttm -52.78 -51.33 61.13 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 26.0 mm-40 -71.03 -45.32 64.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.599 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.5 mt -59.19 -43.66 92.19 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.664 0.269 . . . . 10.0 111.099 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.68 -38.31 96.22 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.574 -0.822 . . . . 10.0 111.084 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -69.68 -28.76 66.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.996 0.426 . . . . 10.0 110.491 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.9 mmtt -68.71 -30.23 68.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.07 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.492 HD11 ' HB3' ' B' ' 66' ' ' LEU . 41.8 mt -86.17 -11.44 52.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.192 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.562 -0.732 . . . . 10.0 110.835 -179.821 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.751 0.31 . . . . 10.0 110.518 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.52 175.68 5.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.4 -55.08 6.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.046 0.451 . . . . 10.0 109.865 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' B' ' 4' ' ' LYS . 13.3 mmmm -136.54 103.65 5.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.543 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.12 144.27 47.03 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.098 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.9 tppt? -75.8 128.56 35.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.331 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.9 p90 -153.52 165.84 34.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.119 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.51 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.6 tp10 -150.51 124.49 9.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.58 110.22 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.199 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -80.77 -41.49 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.335 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -164.71 129.23 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.927 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.68 137.89 39.67 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.419 -0.956 . . . . 10.0 108.419 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.564 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 95.1 mt -108.96 -73.15 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.022 -0.671 . . . . 10.0 111.997 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.502 HD12 ' CB ' ' A' ' 68' ' ' GLU . 15.3 mm -131.22 139.45 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.984 0.421 . . . . 10.0 111.848 -177.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.7 117.2 49.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 177.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -85.7 -80.8 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.798 -0.361 . . . . 10.0 111.677 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.1 m -179.21 -171.61 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 50.3 mp0 -103.08 142.77 33.55 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.131 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -81.21 -171.07 3.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.96 -0.563 . . . . 10.0 109.531 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -18.81 65.56 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.368 0.604 . . . . 10.0 110.918 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 17.7 mttt -97.84 3.99 49.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.308 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.94 6.28 86.93 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.509 -0.853 . . . . 10.0 111.293 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -62.04 102.53 0.29 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.911 0.386 . . . . 10.0 111.372 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.417 ' HG3' ' HG3' ' B' ' 26' ' ' GLU . 16.4 tpp85 -81.72 102.27 10.63 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.831 178.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.72 113.75 22.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.711 0.291 . . . . 10.0 110.299 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.417 ' HG3' ' HG3' ' B' ' 24' ' ' ARG . 53.0 mt-10 -130.87 147.67 52.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.241 0.543 . . . . 10.0 111.193 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.564 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 28.8 tp -115.22 107.87 15.86 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.908 -1.145 . . . . 10.0 107.908 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -133.72 154.11 51.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.867 0.365 . . . . 10.0 111.047 -177.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -88.05 114.19 24.42 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.361 -0.977 . . . . 10.0 108.361 178.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 16.2 m -127.37 158.1 38.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.791 0.329 . . . . 10.0 110.703 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.51 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.2 p -96.81 124.83 40.9 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.941 0.401 . . . . 10.0 110.565 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -63.97 108.68 1.56 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.574 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.477 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 61.9 m-80 58.66 30.69 20.24 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.369 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 36.0 t70 67.31 14.91 9.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.81 -1.087 . . . . 10.0 111.557 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.35 -81.35 0.47 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.053 0.39 . . . . 10.0 112.053 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -94.45 124.83 54.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.465 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 71.0 Cg_endo -83.14 124.13 3.7 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.743 2.296 . . . . 10.0 112.032 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.42 ' HB2' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -145.92 164.46 31.94 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -87.07 130.77 34.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.337 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.47 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.2 t0 -144.58 131.17 19.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.478 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.8 tt -105.22 123.0 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.47 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.9 mtp85 -142.33 -178.08 5.57 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.606 0.595 . . . . 10.0 112.606 -177.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -114.28 143.11 45.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.976 -1.011 . . . . 10.0 112.149 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 54.7 m95 -123.56 166.19 15.86 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.488 -0.778 . . . . 10.0 108.906 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -80.02 159.31 71.11 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.2 -26.1 67.96 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.578 2.186 . . . . 10.0 112.471 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -104.03 0.36 29.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.582 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER 58.84 37.29 24.89 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.577 -0.738 . . . . 10.0 111.766 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -89.87 -38.94 13.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.148 0.499 . . . . 10.0 110.384 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -134.86 174.35 10.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.321 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -147.01 173.07 12.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.929 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.98 -162.55 10.98 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.142 -0.552 . . . . 10.0 112.277 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -96.95 154.2 17.44 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.013 -0.698 . . . . 10.0 111.708 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.44 -122.62 1.77 Allowed Glycine 0 C--N 1.331 0.264 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.384 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.2 tt -152.53 139.84 13.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 117.276 0.538 . . . . 10.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.23 141.96 31.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.1 mt -124.61 126.24 45.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.157 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -73.81 164.56 26.48 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.385 -0.371 . . . . 10.0 110.149 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -58.4 -44.48 89.0 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.491 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.2 pt-20 -65.54 -43.92 88.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 10.0 110.793 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -64.82 -47.64 77.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.385 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.636 ' CE2' HD11 ' B' ' 66' ' ' LEU . 12.5 t80 -59.44 -40.22 86.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.799 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.72 -53.33 46.22 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.595 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.491 ' HB ' HD22 ' A' ' 16' ' ' LEU . 20.1 t -62.05 -42.15 93.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 120.924 0.392 . . . . 10.0 110.261 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.9 tp -58.28 -54.19 49.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.937 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.636 HD11 ' CE2' ' B' ' 62' ' ' PHE . 45.9 mt -61.17 -48.72 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.08 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -50.15 -53.86 24.71 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.75 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.665 ' HB3' HD12 ' A' ' 14' ' ' ILE . 24.3 mm-40 -69.22 -45.69 69.22 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.872 -178.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.473 HD13 ' CD2' ' A' ' 66' ' ' LEU . 70.8 mt -61.09 -42.34 98.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.612 0.244 . . . . 10.0 111.279 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.98 -38.13 96.09 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.673 -0.971 . . . . 10.0 110.673 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -70.09 -30.54 67.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.294 -0.453 . . . . 10.0 110.508 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.9 mmtt -65.65 -31.31 72.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.559 -0.291 . . . . 10.0 111.35 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.522 HD11 ' CB ' ' A' ' 66' ' ' LEU . 29.4 mt -90.36 -3.07 57.96 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.45 -0.786 . . . . 10.0 109.926 179.664 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 mmt . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.819 0.343 . . . . 10.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -93.01 169.46 10.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.698 -0.482 . . . . 10.0 109.698 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.99 -47.4 71.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.081 0.467 . . . . 10.0 110.005 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -137.51 113.92 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.148 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.5 tp -85.1 143.15 29.03 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -78.35 131.67 37.09 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.021 0.439 . . . . 10.0 110.376 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.9 p90 -152.14 171.57 17.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.798 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.543 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.2 tp10 -152.23 121.66 6.82 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.799 -0.445 . . . . 10.0 109.799 179.211 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.598 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.2 mt -79.37 105.7 9.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.904 0.383 . . . . 10.0 110.578 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.36 -51.96 19.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.184 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -162.72 130.54 3.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.141 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.92 144.17 41.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.664 -0.495 . . . . 10.0 109.664 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.493 ' O ' HD13 ' A' ' 14' ' ' ILE . 71.9 mt -109.28 -75.17 0.63 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.783 -0.367 . . . . 10.0 111.915 -178.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.76 HD12 ' HB3' ' B' ' 68' ' ' GLU . 32.1 mm -128.7 141.69 45.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -177.22 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.5 p -125.13 123.33 65.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.489 HD22 ' HB ' ' B' ' 64' ' ' VAL . 35.2 mt -92.24 -79.85 0.38 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.544 -0.462 . . . . 10.0 111.276 -178.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.09 -167.33 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.502 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.7 mp0 -108.53 145.38 34.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.769 0.318 . . . . 10.0 110.516 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -82.28 -173.46 4.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.31 -22.34 66.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.397 0.618 . . . . 10.0 110.509 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -88.62 -1.64 58.17 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.279 -0.873 . . . . 10.0 110.84 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 3.47 81.93 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.611 -0.804 . . . . 10.0 111.294 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.502 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.32 105.5 0.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.693 0.282 . . . . 10.0 111.355 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.4 tpp85 -85.47 100.31 11.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.458 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.2 mttt -82.45 115.84 21.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.617 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG2' HG23 ' A' ' 15' ' ' VAL . 83.5 mt-10 -134.68 147.31 50.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.792 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.61 HD13 ' HB ' ' A' ' 41' ' ' ILE . 35.9 tp -116.88 111.76 20.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.43 -0.805 . . . . 10.0 108.956 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -131.54 163.69 27.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 10.0 111.556 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -98.57 113.75 25.91 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.598 HG12 ' HA ' ' A' ' 9' ' ' ILE . 15.1 m -131.21 159.2 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.007 0.432 . . . . 10.0 111.269 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -96.65 125.14 40.91 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.145 178.821 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.1 m0 -63.81 108.99 1.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.525 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 58.21 31.93 21.4 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.481 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.8 t70 66.68 23.4 10.24 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 114.981 -1.009 . . . . 10.0 111.2 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.62 -88.27 0.46 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.102 -0.374 . . . . 10.0 111.745 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -95.57 124.88 51.51 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.547 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 59.6 Cg_endo -77.57 128.46 9.5 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.814 2.342 . . . . 10.0 111.851 178.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -147.94 170.06 18.52 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -94.98 131.21 41.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.213 -0.291 . . . . 10.0 110.213 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -142.42 132.01 23.91 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.61 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.5 tt -108.09 123.46 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.272 0.558 . . . . 10.0 110.059 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG2' ' HA3' ' A' ' 54' ' ' GLY . 3.4 mtt85 -145.79 177.41 8.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.133 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -124.64 142.55 51.3 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.458 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 28.7 m95 -117.56 171.14 8.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -65.55 156.92 80.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.23 -31.15 75.03 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.607 2.204 . . . . 10.0 112.618 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -97.28 2.79 51.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.178 0.513 . . . . 10.0 110.578 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 59.06 26.81 15.58 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.926 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -78.1 -37.07 47.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.116 0.484 . . . . 10.0 110.824 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -133.57 175.01 9.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.923 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.458 ' HB3' ' CE3' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -138.78 172.55 12.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.366 -0.834 . . . . 10.0 111.104 -177.088 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.85 -163.05 9.36 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.177 -0.535 . . . . 10.0 112.116 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -94.89 155.38 16.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.949 -0.736 . . . . 10.0 112.322 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.444 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.3 -127.05 1.43 Allowed Glycine 0 CA--C 1.518 0.245 0 N-CA-C 110.686 -0.966 . . . . 10.0 110.686 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -148.89 142.63 18.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 117.606 0.703 . . . . 10.0 111.198 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.47 141.15 34.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.839 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -122.09 129.4 52.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.962 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.1 m -74.23 164.97 25.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.013 -0.366 . . . . 10.0 110.013 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.47 -46.68 89.04 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.646 0.239 . . . . 10.0 111.646 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -61.96 -40.8 96.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 10.0 110.488 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.482 ' HB3' HD13 ' B' ' 16' ' ' LEU . 87.5 mt-10 -64.33 -49.79 70.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.357 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.761 ' CE2' HD11 ' A' ' 66' ' ' LEU . 15.1 t80 -57.86 -44.84 86.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.276 -0.874 . . . . 10.0 111.314 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.91 -52.16 53.88 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.284 -0.484 . . . . 10.0 112.477 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.426 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 93.0 t -63.34 -45.06 99.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 110.332 -0.247 . . . . 10.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.464 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 24.1 tp -56.19 -52.15 65.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.761 HD11 ' CE2' ' A' ' 62' ' ' PHE . 20.9 mt -62.54 -44.91 95.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.417 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.1 tttm -53.1 -52.02 59.97 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 123.567 0.542 . . . . 10.0 110.818 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 44.8 mm-40 -66.54 -51.99 50.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.428 -0.806 . . . . 10.0 111.212 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 74.2 mt -56.12 -48.32 76.43 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.184 0.439 . . . . 10.0 112.184 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.28 -39.05 96.66 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.344 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -71.23 -20.72 62.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.032 0.444 . . . . 10.0 111.117 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.691 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.7 mmtt -77.41 -26.68 51.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.601 -0.272 . . . . 10.0 110.796 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.528 HD11 ' HB3' ' B' ' 66' ' ' LEU . 24.5 mt -82.96 -19.2 37.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.996 -0.281 . . . . 10.0 111.297 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.385 -0.817 . . . . 10.0 110.887 -179.605 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.2 mmt . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.712 0.291 . . . . 10.0 110.336 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.53 168.52 11.2 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.424 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 28.9 t70 -68.85 -46.7 67.82 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.424 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 39.5 mmtm -137.19 107.7 6.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.176 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 31.1 tp -79.89 141.07 36.45 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.7 tppt? -77.35 130.17 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.249 0.547 . . . . 10.0 110.738 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -150.94 173.36 14.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.699 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.55 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.4 tp10 -154.72 122.79 5.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.617 ' HA ' HG12 ' B' ' 30' ' ' VAL . 52.9 mt -78.77 108.88 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.133 0.492 . . . . 10.0 110.784 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -78.87 -47.64 22.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.039 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -167.59 130.55 1.66 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.112 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -75.22 145.77 41.72 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 81.2 mt -112.0 -74.66 0.63 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.477 -0.489 . . . . 10.0 111.902 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.628 HD12 ' CB ' ' A' ' 68' ' ' GLU . 16.0 mm -127.24 140.8 48.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.025 0.44 . . . . 10.0 111.903 -177.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.413 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -125.93 122.48 62.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.078 -1.082 . . . . 10.0 108.078 177.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 16' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' A' ' 61' ' ' GLU . 28.8 mt -92.06 -81.29 0.34 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.373 -0.531 . . . . 10.0 111.778 -178.112 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -179.18 -167.71 0.11 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.484 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.15 147.55 31.12 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.348 -0.242 . . . . 10.0 110.348 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -85.15 -172.15 4.02 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.34 -20.82 66.19 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.472 0.654 . . . . 10.0 110.464 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -90.21 -2.55 58.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.177 -0.92 . . . . 10.0 110.323 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 4.52 80.85 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.484 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.7 m0 -62.33 105.99 0.69 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.748 0.308 . . . . 10.0 111.333 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.483 ' O ' ' HA ' ' B' ' 43' ' ' THR . 12.3 tpp85 -85.21 100.31 11.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.593 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.508 ' HG2' HG22 ' B' ' 43' ' ' THR . 93.9 mttt -82.06 115.73 21.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.735 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.413 ' HG2' HG23 ' B' ' 15' ' ' VAL . 90.6 mt-10 -134.23 146.61 50.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.859 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.56 HD13 ' HB ' ' B' ' 41' ' ' ILE . 42.7 tp -115.92 111.86 21.03 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.668 -0.864 . . . . 10.0 108.668 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -132.34 162.29 31.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.126 0.488 . . . . 10.0 111.623 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.1 ttm180 -97.7 113.91 25.77 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.617 HG12 ' HA ' ' B' ' 9' ' ' ILE . 22.8 m -131.55 157.12 43.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.904 0.383 . . . . 10.0 111.297 -178.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.55 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -94.19 125.3 38.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.194 178.785 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -63.88 109.2 1.68 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.543 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.5 m-80 58.5 32.91 22.65 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.831 0.707 . . . . 10.0 110.368 -178.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 67.63 17.79 9.9 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.946 -1.025 . . . . 10.0 111.414 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.04 -89.77 0.38 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.13 0.419 . . . . 10.0 112.13 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -90.96 123.32 65.06 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 112.271 0.471 . . . . 10.0 112.271 -177.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.541 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.87 126.75 8.98 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.831 2.354 . . . . 10.0 111.701 178.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -147.07 170.78 16.43 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -96.94 129.22 44.43 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.325 -0.25 . . . . 10.0 110.325 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.419 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.56 132.25 28.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.279 -0.638 . . . . 10.0 109.279 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.56 ' HB ' HD13 ' B' ' 27' ' ' LEU . 13.2 tt -106.82 122.7 61.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.324 0.583 . . . . 10.0 110.16 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.419 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -145.6 176.8 9.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.002 -0.544 . . . . 10.0 111.257 -178.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.508 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -123.85 142.92 50.68 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.332 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 m95 -117.15 173.37 6.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.103 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.0 m -67.87 157.79 85.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -55.44 -31.44 77.87 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.504 2.136 . . . . 10.0 112.48 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -99.3 6.08 46.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.464 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.48 28.39 15.42 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.102 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.58 -38.45 40.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.725 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -133.41 174.23 10.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.112 0.482 . . . . 10.0 111.128 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.4 172.22 13.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.165 -0.925 . . . . 10.0 111.199 -177.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.88 -161.25 8.67 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.984 -0.627 . . . . 10.0 111.797 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -97.79 153.16 18.47 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 122.17 -0.606 . . . . 10.0 112.485 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.61 -124.26 1.46 Allowed Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.403 -1.079 . . . . 10.0 110.403 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -153.16 143.25 14.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 117.549 0.675 . . . . 10.0 111.219 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.5 143.78 31.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.383 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 63.7 mt -123.19 129.08 50.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.08 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.0 m -74.59 163.09 28.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.79 -44.86 93.74 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 -178.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.485 ' O ' HG23 ' B' ' 64' ' ' VAL . 10.1 pt-20 -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.133 0.492 . . . . 10.0 110.465 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.143 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.532 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -58.01 -41.36 82.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.544 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.53 -52.84 50.52 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.06 -0.59 . . . . 10.0 112.059 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.489 ' HB ' HD22 ' A' ' 16' ' ' LEU . 28.0 t -63.96 -45.0 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 10.0 110.139 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.8 tp -55.72 -51.43 67.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.012 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 65.4 mt -61.19 -48.92 79.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.976 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 46.6 tttm -52.58 -52.54 54.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.549 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.76 ' HB3' HD12 ' A' ' 14' ' ' ILE . 51.2 mm-40 -65.94 -53.18 42.47 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.558 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.538 ' HB3' HD22 ' A' ' 66' ' ' LEU . 61.3 mt -57.96 -44.06 86.8 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.158 0.429 . . . . 10.0 112.158 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.2 -41.04 99.36 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 111.191 -0.764 . . . . 10.0 111.191 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -72.24 -22.5 61.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.314 -0.443 . . . . 10.0 111.565 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.634 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.6 mmtt -72.41 -26.55 61.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.576 HD11 ' CB ' ' A' ' 66' ' ' LEU . 22.5 mt -88.3 -5.88 58.08 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.151 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.453 -0.784 . . . . 10.0 109.884 179.716 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.223 0 CA-C-O 120.69 0.281 . . . . 10.0 110.619 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.12 164.32 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.148 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.6 -48.05 42.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.225 0.536 . . . . 10.0 109.762 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.414 ' HA ' ' HD2' ' A' ' 4' ' ' LYS . 12.8 mmmm -139.48 95.19 2.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.305 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 22.4 tp -68.93 146.33 52.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.439 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 35.3 tptt -79.37 134.83 36.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.652 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -161.87 166.73 25.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.222 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.494 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -151.8 133.07 14.49 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.635 -0.505 . . . . 10.0 109.635 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.421 ' HA ' HG12 ' A' ' 30' ' ' VAL . 72.4 mt -79.85 111.24 16.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.601 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -82.12 -45.81 19.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.056 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -164.73 127.5 2.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.839 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -80.05 142.07 35.27 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.486 ' O ' HD13 ' A' ' 14' ' ' ILE . 48.5 mt -112.12 -73.74 0.66 Allowed 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.409 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.686 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.0 mm -130.23 138.2 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.71 118.3 56.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 107.403 -1.332 . . . . 10.0 107.403 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.467 HD22 ' HB ' ' B' ' 64' ' ' VAL . 28.1 mt -85.81 -82.12 0.2 Allowed 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.138 -0.625 . . . . 10.0 111.808 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.2 m -174.97 -166.34 0.23 Allowed 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.538 -0.541 . . . . 10.0 109.538 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.4 mp0 -109.78 143.15 40.01 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.89 -0.411 . . . . 10.0 109.89 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -81.69 -171.82 3.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.79 -27.93 69.52 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.492 0.663 . . . . 10.0 110.391 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -87.55 3.2 48.43 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.031 -0.986 . . . . 10.0 111.0 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.11 6.27 88.32 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.545 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.434 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -61.9 103.71 0.38 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 10.0 111.416 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.9 tpp85 -81.26 99.53 8.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.185 178.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.486 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.0 mttt -83.96 121.04 26.84 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.957 0.408 . . . . 10.0 110.762 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -136.12 153.34 51.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.944 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.51 HD13 ' HB ' ' A' ' 41' ' ' ILE . 42.6 tp -123.02 106.96 11.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.918 . . . . 10.0 108.646 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -136.58 156.49 48.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.176 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -95.69 114.58 26.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.421 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.4 m -121.86 161.97 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.469 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.494 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -94.39 123.86 38.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.01 0.433 . . . . 10.0 110.43 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.97 108.41 1.49 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.619 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.441 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.7 m-80 60.81 27.4 17.2 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.003 -178.002 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.6 t70 68.62 19.57 8.57 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.938 -1.028 . . . . 10.0 110.914 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.92 -80.09 0.57 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.97 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.68 118.76 69.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -178.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.9 Cg_endo -77.95 120.3 5.0 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.621 2.214 . . . . 10.0 110.711 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.719 ' HE3' HG21 ' A' ' 56' ' ' THR . 17.3 ttpt -145.8 162.97 36.44 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.867 -0.333 . . . . 10.0 110.788 -177.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -86.57 128.32 34.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.558 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.424 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -143.03 131.46 22.24 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.51 ' HB ' HD13 ' A' ' 27' ' ' LEU . 17.9 tt -107.2 123.29 62.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.178 0.513 . . . . 10.0 110.099 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.424 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.1 mtt85 -145.32 177.6 8.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.458 -178.138 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.486 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -124.96 143.95 50.62 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.726 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 m95 -117.71 173.8 6.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.142 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 p -76.64 156.18 83.07 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.23 -27.62 85.49 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.726 2.284 . . . . 10.0 112.715 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -97.37 -4.58 38.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.651 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.29 34.01 16.17 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.45 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -83.93 -39.36 19.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.762 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -140.56 173.74 11.2 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.21 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.55 172.78 12.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.943 -177.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.32 -164.88 10.22 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 121.001 -0.619 . . . . 10.0 112.499 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.5 mttp -95.01 151.92 18.76 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.113 -0.639 . . . . 10.0 112.375 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.78 -128.43 1.89 Allowed Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.277 -0.874 . . . . 10.0 111.479 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -147.34 145.82 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 CA-C-N 117.727 0.764 . . . . 10.0 111.233 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.719 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.2 m -104.96 144.4 31.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.382 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.8 mt -122.43 135.16 54.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.771 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.4 m -77.46 164.51 25.37 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.127 -0.324 . . . . 10.0 110.127 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -59.39 -48.63 80.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.663 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.25 -43.57 97.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.965 0.412 . . . . 10.0 110.804 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -59.14 -48.89 79.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.246 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.651 ' CE2' HD11 ' A' ' 66' ' ' LEU . 33.5 t80 -58.06 -42.15 84.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.006 -0.997 . . . . 10.0 111.167 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.75 34.4 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.277 -0.487 . . . . 10.0 112.489 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 71.5 t -60.38 -43.7 94.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-O 120.969 0.414 . . . . 10.0 110.165 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.465 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -56.48 -52.85 63.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.542 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.691 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.5 mt -62.12 -45.67 92.43 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -52.37 -52.42 53.64 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.431 0.457 . . . . 10.0 111.19 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.576 ' CB ' HD12 ' B' ' 14' ' ' ILE . 52.1 mm-40 -68.69 -48.39 64.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.433 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.2 mt -58.97 -45.09 91.41 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.672 0.249 . . . . 10.0 111.672 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.76 -37.18 94.32 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.688 -0.767 . . . . 10.0 111.575 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -71.92 -30.06 64.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.82 0.343 . . . . 10.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 44.9 mmtt -64.63 -27.91 69.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.01 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' B' ' 66' ' ' LEU . 23.3 mt -88.75 -2.13 58.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 10.0 111.78 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.651 -179.592 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.801 0.334 . . . . 10.0 110.667 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.78 167.22 10.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.598 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -76.39 -47.94 21.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -139.46 99.2 3.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.231 -0.895 . . . . 10.0 110.102 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp -72.88 142.04 47.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.12 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.424 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 10.3 tppt? -77.15 134.39 38.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.948 0.404 . . . . 10.0 110.215 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -160.81 165.17 30.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.897 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.462 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.3 tp10 -149.24 131.96 15.95 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.401 ' HA ' HG12 ' B' ' 30' ' ' VAL . 61.2 mt -77.39 112.95 15.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.08 0.467 . . . . 10.0 110.147 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.0 mm -84.45 -42.8 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.096 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -168.35 127.99 1.22 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.644 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -81.41 140.13 34.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 55.7 mt -111.36 -67.19 1.01 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.496 -0.482 . . . . 10.0 112.244 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.576 HD12 ' CB ' ' A' ' 68' ' ' GLU . 12.0 mm -133.97 136.51 53.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 10.0 111.86 -177.14 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 p -120.74 120.04 61.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.233 -1.395 . . . . 10.0 107.233 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -87.04 -81.86 0.22 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.369 -0.532 . . . . 10.0 111.967 -177.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 5.4 m -177.26 -167.75 0.17 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.117 -0.697 . . . . 10.0 109.117 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.411 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 4.3 mp0 -107.07 143.48 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -82.79 -172.63 4.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.06 -25.38 68.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.31 0.576 . . . . 10.0 110.817 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -90.1 2.04 55.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.493 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.1 6.96 84.12 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.493 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.411 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.4 m0 -62.64 103.54 0.43 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.605 0.24 . . . . 10.0 111.613 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -80.35 99.98 8.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.514 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.3 mttt -84.23 119.81 25.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 10.0 110.754 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -135.5 151.59 50.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.991 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.489 HD13 ' HB ' ' B' ' 41' ' ' ILE . 39.2 tp -121.62 107.24 12.15 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -136.63 155.5 49.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.283 -178.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -94.81 115.0 26.96 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.8 m -122.26 161.68 22.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.46 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.462 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.4 p -94.34 123.49 37.78 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.273 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -63.53 109.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.448 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.424 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.4 m-80 59.06 30.9 20.82 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 123.734 0.646 . . . . 10.0 109.785 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 63.94 26.27 14.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.924 -1.035 . . . . 10.0 111.159 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.24 -78.17 0.58 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.729 -0.388 . . . . 10.0 111.755 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -88.75 117.02 67.88 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.413 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 47.9 Cg_endo -77.93 120.06 4.93 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.292 1.995 . . . . 10.0 110.481 178.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.693 ' HE3' HG21 ' B' ' 56' ' ' THR . 16.8 ttpt -146.08 164.0 33.51 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.895 -0.322 . . . . 10.0 110.442 -178.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -88.11 128.45 35.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.505 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -142.94 131.91 22.94 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.379 -0.601 . . . . 10.0 109.379 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.489 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.1 tt -107.03 123.22 62.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 121.514 0.673 . . . . 10.0 110.289 -179.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.405 ' HG2' ' HA3' ' B' ' 54' ' ' GLY . 4.1 mtt85 -145.54 177.55 8.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.394 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.514 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.47 144.49 50.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.854 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 42.0 m95 -118.06 174.03 6.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.312 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -77.3 156.65 81.38 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -30.01 87.3 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.652 2.234 . . . . 10.0 112.704 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -98.16 -2.94 38.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.934 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.03 31.38 13.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.545 -179.197 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -79.63 -39.18 32.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.967 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.19 174.05 10.96 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.36 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' MET . . . . . 0.401 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -136.02 172.99 12.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 10.0 110.927 -178.147 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -136.47 -163.08 9.71 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.113 -0.565 . . . . 10.0 112.273 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -97.4 149.01 22.6 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.033 -0.686 . . . . 10.0 112.33 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.405 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -141.45 -129.11 2.43 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.342 -0.845 . . . . 10.0 111.003 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -147.82 146.68 17.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.343 0.572 . . . . 10.0 110.397 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.693 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.1 m -104.38 145.36 30.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.58 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.5 mt -123.09 133.72 54.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.691 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -76.58 164.25 26.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.11 -46.92 88.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.829 0.307 . . . . 10.0 111.829 -178.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.517 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.0 pt-20 -65.46 -41.57 93.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -61.15 -49.25 77.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.156 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.96 -39.02 80.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.629 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.18 -52.24 53.17 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.934 -0.65 . . . . 10.0 112.287 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 60' ' ' GLU . 12.1 t -63.37 -44.71 99.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 10.0 110.05 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 15.7 tp -54.87 -52.36 63.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.816 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 73' ' ' LEU . 77.9 mt -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.989 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -49.89 -53.93 22.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.642 -0.708 . . . . 10.0 111.871 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.686 ' HB3' HD12 ' A' ' 14' ' ' ILE . 13.8 mm-40 -68.84 -47.89 64.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.97 -0.559 . . . . 10.0 112.093 -178.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.691 ' HB3' HD22 ' A' ' 66' ' ' LEU . 69.0 mt -61.65 -43.53 98.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.746 0.308 . . . . 10.0 111.696 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -35.65 92.34 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.517 -0.633 . . . . 10.0 111.517 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' ASN . . . . . 0.435 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 21.1 t-20 -74.55 -27.63 60.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 10.0 110.872 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.5 mmtt -65.55 -29.04 69.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.837 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.0 mt -90.71 6.64 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.965 -0.294 . . . . 10.0 111.655 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' GLU . . . . . 0.435 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.2 mt-10 . . . . . 0 C--O 1.245 0.829 0 CA-C-O 118.197 -0.906 . . . . 10.0 110.525 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.15 155.44 17.74 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.58 -55.29 24.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 10.0 109.815 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -132.35 93.89 3.34 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.335 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 20.2 tp -65.81 150.79 48.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.355 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 15.4 tppt? -77.63 133.25 38.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.636 0.255 . . . . 10.0 110.455 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -159.14 167.95 27.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.535 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -154.11 129.48 9.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.401 ' HA ' HG12 ' A' ' 30' ' ' VAL . 49.1 mt -79.13 112.58 17.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.142 0.496 . . . . 10.0 110.704 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -79.42 -40.18 21.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.653 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -169.02 141.91 2.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.247 -0.888 . . . . 10.0 110.347 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.89 135.95 33.17 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.615 -0.883 . . . . 10.0 108.615 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 91.2 mt -104.24 -75.29 0.62 Allowed 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.573 -0.451 . . . . 10.0 111.375 -179.172 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.714 HD12 ' HB3' ' B' ' 68' ' ' GLU . 32.6 mm -131.68 139.22 51.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 10.0 112.074 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.9 p -122.63 125.79 73.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 107.622 -1.251 . . . . 10.0 107.622 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.481 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -93.89 -81.05 0.38 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.214 -0.595 . . . . 10.0 111.813 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.5 m -177.76 -169.78 0.23 Allowed 'General case' 0 C--O 1.237 0.4 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 -179.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.0 mp0 -104.27 140.62 37.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.374 . . . . 10.0 110.001 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -80.61 -172.0 3.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.61 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.2 -26.47 68.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.716 0.77 . . . . 10.0 110.855 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -91.65 3.93 53.89 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.736 -1.12 . . . . 10.0 111.243 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.23 5.89 89.25 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.518 -0.849 . . . . 10.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -62.95 104.05 0.51 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.928 0.394 . . . . 10.0 110.919 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.498 ' O ' ' HA ' ' A' ' 43' ' ' THR . 10.5 tpp85 -81.69 99.74 9.08 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.668 -0.696 . . . . 10.0 109.473 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.3 mttt -82.43 117.28 22.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.947 0.403 . . . . 10.0 110.713 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -131.53 148.88 52.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.165 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.558 HD13 ' HB ' ' A' ' 41' ' ' ILE . 43.2 tp -119.06 107.77 13.91 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 178.098 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -135.11 163.03 30.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.931 0.396 . . . . 10.0 110.746 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -98.66 114.85 27.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 9' ' ' ILE . 18.9 m -125.64 157.87 34.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 10.0 111.01 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.535 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 3.3 p -94.71 123.64 38.27 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.098 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -64.25 110.04 2.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.638 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.8 m-80 60.53 29.38 18.97 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 123.796 0.685 . . . . 10.0 110.452 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 61.83 34.37 17.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 114.692 -1.14 . . . . 10.0 110.594 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.5 -77.43 0.59 Allowed 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.26 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -88.66 115.24 62.89 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.667 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.1 Cg_endo -78.26 121.01 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.517 2.145 . . . . 10.0 111.292 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.47 ' HE3' HG21 ' A' ' 56' ' ' THR . 17.0 ttpt -149.73 163.38 38.11 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.948 -0.301 . . . . 10.0 110.698 -178.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -85.51 135.29 33.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -148.84 132.1 16.47 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.558 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.9 tt -107.21 122.11 60.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.325 0.583 . . . . 10.0 109.945 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.445 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.4 mtt85 -143.83 179.36 7.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.209 -177.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.498 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -125.9 145.18 50.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.027 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.5 m95 -117.48 173.85 6.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.214 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.5 p -78.76 159.34 74.14 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -59.47 -27.22 84.41 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.354 2.036 . . . . 10.0 112.422 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -96.11 -0.86 49.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.249 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 55.7 34.89 24.23 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.752 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -92.55 -39.8 11.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.753 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -131.58 174.29 10.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.693 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.424 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -153.4 173.1 16.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.032 -177.674 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.77 -159.56 9.25 Favored Glycine 0 C--O 1.226 -0.38 0 C-N-CA 120.941 -0.647 . . . . 10.0 111.977 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -93.65 161.33 14.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.272 0.536 . . . . 10.0 112.3 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.96 -127.28 1.3 Allowed Glycine 0 CA--C 1.519 0.333 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.974 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -147.88 143.27 19.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 117.838 0.819 . . . . 10.0 111.269 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.47 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.1 m -100.85 145.92 27.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.231 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.1 mt -125.41 127.1 46.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.849 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -76.37 163.02 27.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.008 -0.367 . . . . 10.0 110.008 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -55.9 -50.67 70.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.934 0.346 . . . . 10.0 111.934 -178.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -61.61 -46.37 90.13 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.789 0.328 . . . . 10.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -60.27 -47.82 84.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.114 0.483 . . . . 10.0 110.476 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.666 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.2 t80 -59.43 -46.82 87.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.282 -0.872 . . . . 10.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.75 -53.29 46.4 Favored Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 116.178 -0.464 . . . . 10.0 112.578 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.492 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 88.6 t -61.21 -45.55 98.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.674 0.273 . . . . 10.0 110.28 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.55 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 23.2 tp -54.66 -53.05 59.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.669 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.666 HD11 ' CE2' ' A' ' 62' ' ' PHE . 18.4 mt -62.62 -44.45 96.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.323 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -51.98 -50.35 61.45 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.063 0.459 . . . . 10.0 110.943 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.612 ' CB ' HD12 ' B' ' 14' ' ' ILE . 56.7 mm-40 -68.13 -49.53 60.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.146 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 91.1 mt -58.27 -43.86 88.16 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.662 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.09 96.5 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.335 -0.706 . . . . 10.0 111.335 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -73.08 -28.59 62.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.625 0.25 . . . . 10.0 110.72 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 70.1 mmtt -66.67 -28.0 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.644 -0.253 . . . . 10.0 111.467 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' B' ' 66' ' ' LEU . 23.1 mt -85.8 -16.24 39.41 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.096 -0.242 . . . . 10.0 111.54 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.486 -0.769 . . . . 10.0 110.715 -179.194 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 120.796 0.332 . . . . 10.0 110.169 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.41 154.55 18.97 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.04 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.431 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 19.0 t70 -62.53 -56.07 21.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.361 0.601 . . . . 10.0 109.711 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 13.3 mmmm -131.96 95.01 3.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.256 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 20.9 tp -65.77 149.5 50.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.598 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -76.51 132.99 39.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.405 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -160.09 167.5 27.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.464 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.7 tp10 -153.07 129.18 10.4 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.455 ' HA ' HG12 ' B' ' 30' ' ' VAL . 68.7 mt -78.03 111.24 14.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.348 0.594 . . . . 10.0 110.555 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 mm -78.77 -41.52 24.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.776 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -169.14 139.21 2.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.34 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.74 141.45 30.53 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 83.5 mt -111.02 -70.46 0.81 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.139 -0.624 . . . . 10.0 111.617 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.612 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.3 mm -132.86 139.61 49.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.061 0.458 . . . . 10.0 111.582 -177.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.416 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.7 p -124.62 123.61 66.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 107.807 -1.182 . . . . 10.0 107.807 177.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 41.4 mt -92.73 -81.85 0.34 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.391 -0.524 . . . . 10.0 111.803 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.34 -170.45 0.22 Allowed 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 -179.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -102.84 139.39 38.47 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -79.08 -171.46 2.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.84 -17.82 65.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.431 0.634 . . . . 10.0 111.055 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -99.3 5.87 46.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.76 3.51 90.47 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.529 -0.843 . . . . 10.0 111.181 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -61.78 104.11 0.41 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.885 0.374 . . . . 10.0 111.039 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.7 tpp85 -82.82 100.0 10.05 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.621 179.121 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.53 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.6 mttt -82.11 117.47 22.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.899 0.381 . . . . 10.0 110.758 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.416 ' HG2' HG23 ' B' ' 15' ' ' VAL . 58.3 mt-10 -131.67 146.78 52.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.08 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.562 HD13 ' HB ' ' B' ' 41' ' ' ILE . 44.3 tp -117.56 107.16 13.93 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -135.22 161.81 34.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.498 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -99.43 115.05 28.37 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.455 HG12 ' HA ' ' B' ' 9' ' ' ILE . 23.0 m -124.63 159.37 30.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.76 -178.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.464 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.4 p -95.8 124.01 39.63 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.306 179.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -63.84 112.64 2.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.678 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 58.63 29.46 18.55 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.472 -177.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 62.94 32.96 15.35 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.068 -0.969 . . . . 10.0 111.099 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.06 -70.7 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.95 0.352 . . . . 10.0 111.95 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -92.46 113.59 59.84 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.738 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.07 119.95 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.393 2.062 . . . . 10.0 110.753 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.559 ' HE3' HG21 ' B' ' 56' ' ' THR . 19.4 ttpt -148.9 163.9 36.08 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.709 0.29 . . . . 10.0 110.37 -178.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -87.63 135.57 33.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.922 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -149.13 132.22 16.3 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.562 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.9 tt -106.84 123.58 61.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.206 0.527 . . . . 10.0 109.855 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.428 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.7 mtt85 -144.56 179.78 7.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.234 -177.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.53 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -126.23 144.87 50.62 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.037 -0.528 . . . . 10.0 109.954 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 36.4 m95 -117.8 174.52 6.13 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.039 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -79.08 160.08 71.84 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.713 -0.477 . . . . 10.0 109.713 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.63 -27.23 84.45 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.193 1.929 . . . . 10.0 112.103 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -95.78 -4.33 44.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.272 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.06 31.81 20.76 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.117 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -89.18 -39.77 13.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.982 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -131.63 173.17 11.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.872 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' MET . . . . . 0.421 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -150.95 172.45 15.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.772 -177.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.21 -159.72 9.42 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.318 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -93.65 156.97 16.4 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.083 -0.657 . . . . 10.0 112.262 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.62 -128.41 1.91 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.766 -0.934 . . . . 10.0 110.766 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -146.84 143.47 20.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 117.618 0.709 . . . . 10.0 110.796 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.559 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.1 m -100.83 144.52 29.68 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.771 -0.649 . . . . 10.0 111.642 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -123.62 127.29 48.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.051 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -77.03 165.98 23.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.142 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -59.82 -47.69 84.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.53 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.0 pt-20 -65.65 -43.74 88.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.897 0.38 . . . . 10.0 110.866 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 73.0 mt-10 -62.41 -47.37 84.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.414 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.42 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.0 t80 -61.96 -41.36 97.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.727 -0.67 . . . . 10.0 110.612 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.59 -53.28 47.33 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.197 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.53 HG23 ' O ' ' B' ' 60' ' ' GLU . 23.3 t -61.33 -47.47 93.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 10.0 110.216 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.5 tp -53.62 -51.62 62.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.889 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.463 ' HB3' HD11 ' A' ' 73' ' ' LEU . 56.6 mt -61.07 -48.61 80.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.139 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -52.05 -51.21 59.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.463 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.714 ' HB3' HD12 ' A' ' 14' ' ' ILE . 58.9 mm-40 -66.57 -50.73 62.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.67 -0.695 . . . . 10.0 111.582 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.658 ' HB3' HD22 ' A' ' 66' ' ' LEU . 95.6 mt -60.58 -40.74 92.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.952 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.54 -40.81 99.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.51 -0.853 . . . . 10.0 111.092 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -72.0 -28.68 63.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.644 0.259 . . . . 10.0 111.215 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -66.01 -26.45 67.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.593 0.22 . . . . 10.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.585 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.0 mt -90.07 -10.27 45.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.944 -0.303 . . . . 10.0 111.514 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.425 -0.798 . . . . 10.0 109.89 179.712 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 121.003 0.43 . . . . 10.0 110.564 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.44 172.67 7.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.024 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -74.7 -51.8 13.31 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.742 -0.466 . . . . 10.0 109.742 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.53 94.05 3.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.946 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.17 144.47 57.18 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.401 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 14.7 tppt? -78.1 130.84 36.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.932 0.396 . . . . 10.0 110.471 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -157.0 172.33 18.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.644 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.402 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.5 tp10 -154.88 134.76 12.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.417 ' HA ' HG12 ' A' ' 30' ' ' VAL . 56.4 mt -82.87 111.65 19.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 10.0 110.56 -179.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.12 -47.66 19.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.507 -0.769 . . . . 10.0 110.201 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -160.99 130.82 4.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.001 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.61 129.07 35.14 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.555 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 55.8 mt -98.95 -75.66 0.55 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.285 -0.566 . . . . 10.0 111.632 -178.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.662 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.8 mm -134.39 141.11 44.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.992 0.425 . . . . 10.0 112.029 -177.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.1 p -121.8 122.67 67.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.087 -1.079 . . . . 10.0 108.087 177.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.589 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -90.78 -80.65 0.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.303 -0.559 . . . . 10.0 111.882 -177.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -175.17 -167.62 0.28 Allowed 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.475 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 3.5 mp0 -115.84 134.77 54.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.792 0.33 . . . . 10.0 110.338 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -73.12 -174.2 1.49 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.15 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.51 -26.12 68.56 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 121.553 0.692 . . . . 10.0 110.418 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -85.24 -2.04 57.61 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.0 -1.0 . . . . 10.0 110.868 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.75 6.19 83.12 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.76 -0.936 . . . . 10.0 110.76 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.475 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.3 m0 -62.01 103.66 0.39 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.031 0.443 . . . . 10.0 111.513 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.551 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.6 tpp85 -80.88 99.1 8.16 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.29 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HG2' HG22 ' A' ' 43' ' ' THR . 90.8 mttt -83.2 113.26 20.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.064 0.459 . . . . 10.0 110.614 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.405 ' HG2' HG23 ' A' ' 15' ' ' VAL . 64.1 mt-10 -132.01 150.06 52.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.416 -0.811 . . . . 10.0 111.238 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.688 HD13 ' HB ' ' A' ' 41' ' ' ILE . 44.6 tp -117.85 109.34 16.43 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.664 -1.236 . . . . 10.0 107.664 178.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -134.76 156.94 47.97 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.087 0.47 . . . . 10.0 111.326 -177.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.1 ttm180 -96.85 114.55 26.19 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 10.0 108.781 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.417 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.8 m -126.73 159.98 35.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.8 0.334 . . . . 10.0 110.943 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.0 OUTLIER -95.62 122.99 38.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.316 179.125 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -64.47 111.43 2.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.897 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.2 m-80 59.47 29.07 18.59 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.816 0.698 . . . . 10.0 110.286 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.4 t0 66.72 24.42 9.97 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.468 -1.242 . . . . 10.0 111.143 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.69 -91.58 0.44 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.534 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -83.88 123.92 75.34 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.722 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.9 Cg_endo -82.29 122.59 3.72 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.025 2.483 . . . . 10.0 111.701 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -142.89 164.56 29.75 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.769 -0.373 . . . . 10.0 110.128 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -89.35 128.86 35.94 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -139.71 131.46 27.45 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.688 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.5 tt -108.0 121.28 60.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.521 0.676 . . . . 10.0 109.952 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.429 ' HG2' ' HA3' ' A' ' 54' ' ' GLY . 3.5 mtt85 -144.75 -178.14 5.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.069 -177.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.551 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -126.11 144.41 50.75 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.781 179.499 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -117.14 179.75 3.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.894 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 p -81.95 161.37 60.88 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 -32.19 93.68 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.292 1.995 . . . . 10.0 112.156 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.96 -5.96 54.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.403 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 62.12 36.26 15.25 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.545 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 50' ' ' LYS . 8.8 pt-20 -93.89 -40.48 10.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.857 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.404 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 43.6 mmtm -126.94 172.26 10.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.448 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.438 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -152.45 173.34 15.24 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.35 -177.762 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -134.06 -161.37 9.59 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.263 -0.97 . . . . 10.0 112.589 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -89.87 154.83 19.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.003 0.43 . . . . 10.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.429 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.35 -128.02 1.52 Allowed Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.163 -0.926 . . . . 10.0 111.156 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -143.33 143.5 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 117.755 0.777 . . . . 10.0 111.192 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.06 140.81 39.28 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.323 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.39 128.71 49.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.544 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 69.8 m -84.34 170.24 13.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.492 -0.322 . . . . 10.0 110.551 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -52.9 -51.94 59.39 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.106 0.78 . . . . 10.0 113.106 -178.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.99 -46.67 86.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.743 0.306 . . . . 10.0 111.463 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.07 -48.73 78.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.21 0.528 . . . . 10.0 110.67 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.648 ' CE2' HD11 ' A' ' 66' ' ' LEU . 32.9 t80 -61.77 -43.11 99.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.217 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.68 -52.41 53.21 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.862 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.416 ' HB ' HD22 ' B' ' 16' ' ' LEU . 58.7 t -60.62 -41.55 88.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.14 0.495 . . . . 10.0 110.083 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.7 tp -59.11 -55.25 37.42 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.422 -0.808 . . . . 10.0 110.667 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.689 HD22 ' HB3' ' B' ' 69' ' ' LEU . 16.5 mt -59.45 -47.02 87.09 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -48.86 -55.59 11.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.593 -0.73 . . . . 10.0 111.626 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.547 ' CB ' HD12 ' B' ' 14' ' ' ILE . 62.6 mm-40 -72.28 -41.99 66.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.768 -178.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.0 mt -59.66 -45.89 90.67 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.637 0.256 . . . . 10.0 111.583 -179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.06 -36.78 93.41 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.367 -0.921 . . . . 10.0 111.076 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -67.55 -25.0 65.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 10.0 110.891 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.7 mmtt -72.37 -26.88 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.447 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.484 HD11 ' HB3' ' B' ' 66' ' ' LEU . 35.2 mt -88.14 -18.74 28.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.637 0.256 . . . . 10.0 111.009 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.594 -0.717 . . . . 10.0 111.044 -179.529 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.897 0.38 . . . . 10.0 110.425 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.82 167.06 10.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.403 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 31.6 t70 -70.82 -53.98 13.29 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.403 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 20.7 mmtm -132.76 94.26 3.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.835 179.213 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 27.2 tp -65.57 142.23 58.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.808 0.337 . . . . 10.0 110.268 179.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.9 tppt? -75.26 126.98 32.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.58 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -153.01 171.69 17.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.914 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.531 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.7 tp10 -155.15 132.01 10.73 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.435 ' HA ' HG12 ' B' ' 30' ' ' VAL . 53.4 mt -81.22 114.46 22.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.203 0.525 . . . . 10.0 110.633 -179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.1 mm -86.42 -41.0 14.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -166.17 130.04 2.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.651 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.86 132.24 39.05 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.736 -0.838 . . . . 10.0 108.736 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 29.3 mt -102.97 -72.91 0.68 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.384 -0.526 . . . . 10.0 111.76 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.547 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.0 mm -136.66 137.94 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.918 0.389 . . . . 10.0 112.016 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 p -119.0 122.98 70.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' LEU . . . . . 0.416 HD22 ' HB ' ' A' ' 64' ' ' VAL . 38.6 mt -90.67 -80.34 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.599 -0.44 . . . . 10.0 111.433 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -177.06 -167.18 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.3 mt-10 -115.78 136.43 53.06 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.924 -0.398 . . . . 10.0 109.924 179.022 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -74.14 -175.35 2.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.214 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.83 -25.64 68.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.289 0.566 . . . . 10.0 110.751 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -86.12 0.51 53.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.52 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 6.36 85.14 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.284 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.501 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -62.5 104.31 0.5 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.971 0.415 . . . . 10.0 111.705 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.538 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.2 tpp85 -80.56 99.57 8.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.272 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.605 ' HG2' HG22 ' B' ' 43' ' ' THR . 91.5 mttt -83.2 114.09 21.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.969 0.414 . . . . 10.0 110.798 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -133.67 151.56 51.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.756 HD13 ' HB ' ' B' ' 41' ' ' ILE . 48.3 tp -119.01 109.07 15.51 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.539 -1.282 . . . . 10.0 107.539 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -133.95 156.59 47.87 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.152 0.501 . . . . 10.0 111.209 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -96.71 114.33 25.96 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' B' ' 9' ' ' ILE . 14.5 m -126.65 160.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.86 0.362 . . . . 10.0 110.86 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.531 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -96.53 123.02 40.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.371 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -64.07 111.23 2.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.903 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.421 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 66.2 m-80 60.12 29.32 18.91 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.064 -178.067 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.8 t70 69.38 16.04 8.35 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.176 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.15 -93.56 0.32 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.164 0.431 . . . . 10.0 112.164 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -80.03 122.62 83.32 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.792 0.33 . . . . 10.0 111.751 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 82.9 Cg_endo -82.16 124.38 4.3 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.894 2.396 . . . . 10.0 111.591 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -143.78 165.69 26.98 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -91.14 128.7 37.06 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t0 -139.15 130.19 26.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.756 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.2 tt -106.18 121.55 58.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 121.441 0.638 . . . . 10.0 109.934 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.445 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.1 mtt85 -144.88 -178.07 5.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.257 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.605 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.85 144.77 50.52 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.123 -0.489 . . . . 10.0 109.937 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -117.41 179.54 4.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.12 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.73 161.75 57.59 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.42 -35.28 96.19 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.312 2.008 . . . . 10.0 112.082 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -89.17 -5.47 57.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.549 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.55 37.24 16.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.898 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -94.04 -39.7 10.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.632 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -128.77 169.87 14.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.015 0.436 . . . . 10.0 110.942 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' MET . . . . . 0.407 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -149.68 172.83 14.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.343 -177.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.72 -162.83 10.19 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.959 -0.638 . . . . 10.0 112.212 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -89.11 153.45 20.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.202 0.525 . . . . 10.0 112.197 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.435 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -147.32 -128.73 1.87 Allowed Glycine 0 C--N 1.331 0.282 0 N-CA-C 110.645 -0.982 . . . . 10.0 110.645 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -143.37 141.97 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 117.665 0.733 . . . . 10.0 111.13 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.11 142.25 35.22 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.254 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -125.76 126.45 44.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.582 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.9 m -79.92 171.52 15.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.25 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -55.85 -52.51 63.78 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.301 0.482 . . . . 10.0 112.301 -178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.589 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.3 pt-20 -60.88 -44.59 96.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.787 0.327 . . . . 10.0 111.447 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -64.39 -49.59 71.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.001 0.429 . . . . 10.0 110.848 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -62.65 -39.32 93.51 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.908 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.97 -54.02 40.92 Favored Glycine 0 C--N 1.328 0.128 0 C-N-CA 121.163 -0.541 . . . . 10.0 112.961 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.589 ' HB ' HD22 ' A' ' 16' ' ' LEU . 13.0 t -61.36 -39.68 83.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.161 0.505 . . . . 10.0 109.904 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.0 tp -59.87 -55.11 38.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.278 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.484 ' HB3' HD11 ' A' ' 73' ' ' LEU . 75.5 mt -58.03 -49.47 76.74 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.212 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.7 tttm -49.14 -57.18 7.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.016 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.662 ' HB3' HD12 ' A' ' 14' ' ' ILE . 65.5 mm-40 -70.48 -42.91 70.77 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.24 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.689 ' HB3' HD22 ' A' ' 66' ' ' LEU . 49.0 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.609 0.226 . . . . 10.0 111.609 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.95 -35.66 92.29 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' ASN . . . . . 0.41 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 10.6 t-20 -70.3 -27.26 64.25 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.951 0.405 . . . . 10.0 111.143 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 52.1 mmtt -69.0 -27.11 65.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.594 -0.276 . . . . 10.0 111.59 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 66' ' ' LEU . 27.6 mt -89.91 -5.81 56.39 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.774 -0.37 . . . . 10.0 111.63 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 74' ' ' GLU . . . . . 0.41 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.2 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.663 -0.684 . . . . 10.0 110.362 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.622 0.249 . . . . 10.0 110.749 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.14 150.25 25.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.519 -0.548 . . . . 10.0 109.519 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.461 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 36.8 t70 -63.35 -41.16 98.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.846 0.355 . . . . 10.0 110.574 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 21.3 mmtm -135.79 103.56 5.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.062 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.0 tp -87.31 142.2 28.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -75.28 126.32 30.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.29 0.567 . . . . 10.0 110.744 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.3 p90 -146.34 169.71 18.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.637 -0.711 . . . . 10.0 109.154 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.487 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.0 tp10 -153.84 122.1 6.14 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.443 ' HA ' HG12 ' A' ' 30' ' ' VAL . 64.4 mt -73.23 112.97 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.078 0.466 . . . . 10.0 110.362 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -85.16 -42.76 16.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.144 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -165.48 134.23 3.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.853 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -85.71 133.25 34.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.4 mt -102.15 -75.8 0.59 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.5 -0.48 . . . . 10.0 111.9 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.65 HD12 ' HB3' ' B' ' 68' ' ' GLU . 35.6 mm -131.74 137.27 55.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.568 0.581 . . . . 10.0 112.568 -177.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.426 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.0 p -116.31 120.68 65.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.219 -1.03 . . . . 10.0 108.219 177.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.3 mt -87.77 -81.44 0.24 Allowed 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.386 -0.526 . . . . 10.0 111.768 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m -178.29 -168.69 0.16 Allowed 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.63 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 14.8 mp0 -114.48 139.04 49.87 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.204 0.315 . . . . 10.0 110.924 179.579 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -76.1 -171.81 1.82 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.318 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.92 -26.45 68.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.311 0.577 . . . . 10.0 111.173 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -88.51 1.8 54.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.361 -0.836 . . . . 10.0 111.133 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.24 4.38 88.16 Favored Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.68 ' HB3' HG21 ' A' ' 43' ' ' THR . 37.9 m0 -57.74 107.96 0.51 Allowed 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.259 -0.47 . . . . 10.0 111.911 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.9 tpp85 -86.86 104.86 16.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.889 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.539 ' CG ' HG23 ' A' ' 43' ' ' THR . 83.3 mttt -91.68 117.41 29.72 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.277 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.426 ' HG2' HG23 ' A' ' 15' ' ' VAL . 58.2 mt-10 -135.55 147.86 48.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.466 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.755 HD13 ' HB ' ' A' ' 41' ' ' ILE . 39.4 tp -114.02 108.18 16.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.11 -0.95 . . . . 10.0 108.578 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -135.1 169.24 17.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.933 0.397 . . . . 10.0 110.832 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.446 ' HD3' ' CE1' ' A' ' 39' ' ' TYR . 10.0 ttp180 -108.86 118.01 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.9 m -127.16 161.33 34.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.724 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.487 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.8 p -96.48 123.58 40.19 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.217 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.4 109.25 1.86 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.714 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 62.1 23.96 14.2 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.301 0.572 . . . . 10.0 109.826 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t0 66.6 23.68 10.3 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.521 -1.218 . . . . 10.0 111.088 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.47 -79.64 0.52 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.901 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -98.32 125.05 44.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.583 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.0 Cg_endo -82.21 125.88 4.74 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.801 2.334 . . . . 10.0 111.66 178.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.2 ttmm -146.38 163.92 34.08 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.446 ' CE1' ' HD3' ' A' ' 29' ' ' ARG . 7.6 m-85 -84.68 129.65 34.81 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.188 -0.301 . . . . 10.0 110.188 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.465 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -143.32 127.32 17.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.755 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -105.09 123.41 59.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 CA-C-O 121.154 0.502 . . . . 10.0 109.729 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.465 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtp85 -142.91 -179.17 6.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.389 0.614 . . . . 10.0 112.27 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.68 HG21 ' HB3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -124.26 135.75 53.64 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.715 -1.129 . . . . 10.0 110.404 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -122.37 165.34 16.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.721 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -67.98 152.53 96.34 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.121 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.19 -35.88 95.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.85 2.367 . . . . 10.0 113.109 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.48 -4.92 59.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.949 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 63.0 28.94 16.43 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.833 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.419 ' H ' ' HG2' ' A' ' 49' ' ' GLU . 9.7 pt-20 -79.18 -35.41 41.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.705 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.3 mmmm -141.08 174.55 10.41 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.328 0.585 . . . . 10.0 111.63 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.57 168.06 19.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.888 -1.051 . . . . 10.0 110.889 -178.202 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.38 -171.77 12.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.056 -0.593 . . . . 10.0 112.144 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.7 mttp -90.97 151.62 21.01 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.154 -0.615 . . . . 10.0 111.838 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.07 -123.48 1.44 Allowed Glycine 0 C--N 1.333 0.398 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.6 141.07 15.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 121.366 0.603 . . . . 10.0 111.751 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.72 143.41 30.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.75 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.5 mt -119.77 128.4 53.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.378 -0.373 . . . . 10.0 110.258 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.8 m -76.16 162.93 27.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -56.64 -48.66 77.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.024 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -64.26 -43.39 95.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.004 0.431 . . . . 10.0 110.717 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.15 -51.89 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.289 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.41 -36.75 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.65 -52.49 52.16 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 121.201 -0.523 . . . . 10.0 112.032 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.1 t -64.63 -41.96 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.957 0.408 . . . . 10.0 110.075 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.447 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 13.0 tp -56.46 -52.86 63.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.443 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.872 ' HB3' HD11 ' B' ' 73' ' ' LEU . 19.0 mt -62.07 -47.04 86.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.917 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -50.48 -52.91 33.93 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.558 0.536 . . . . 10.0 111.115 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 7.5 mm-40 -70.35 -51.51 29.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.649 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.482 ' HB3' HD22 ' B' ' 66' ' ' LEU . 72.8 mt -55.37 -45.89 76.53 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -178.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.48 -39.27 97.08 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.688 -0.768 . . . . 10.0 111.34 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -72.89 -26.77 61.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.82 0.343 . . . . 10.0 110.882 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.662 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 40.5 mmtt -67.32 -30.21 69.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.548 -0.296 . . . . 10.0 110.479 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' B' ' 66' ' ' LEU . 26.0 mt -77.34 -22.2 52.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.274 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.629 -0.7 . . . . 10.0 110.389 -179.714 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.965 0.412 . . . . 10.0 110.315 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.39 150.77 23.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.22 -0.446 . . . . 10.0 109.817 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 29.0 t70 -63.79 -41.34 97.95 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.116 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.456 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 31.1 mmtm -134.35 104.82 6.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.952 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 23.7 tp -88.2 141.4 28.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 28.4 tptt -75.81 124.66 27.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.418 0.628 . . . . 10.0 110.66 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -144.58 168.37 20.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.22 -0.9 . . . . 10.0 108.839 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.476 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 12.7 tp10 -151.68 119.71 6.25 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.615 ' HA ' HG12 ' B' ' 30' ' ' VAL . 63.8 mt -70.86 110.79 4.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.066 0.46 . . . . 10.0 110.275 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 34.7 mm -83.44 -43.45 18.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.278 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -164.08 132.92 3.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.953 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -83.9 135.04 34.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 62.7 mt -105.51 -74.74 0.64 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.547 -0.461 . . . . 10.0 111.845 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.522 HD12 ' CB ' ' A' ' 68' ' ' GLU . 17.5 mm -130.77 137.23 56.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.434 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.5 p -117.56 118.14 57.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.168 -1.049 . . . . 10.0 108.168 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -86.68 -81.69 0.22 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.441 -0.504 . . . . 10.0 111.716 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.68 -168.83 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.835 0.454 . . . . 10.0 109.81 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.634 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 15.7 mp0 -113.59 141.53 47.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.517 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -76.98 -169.41 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.764 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.21 -20.71 64.86 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.142 0.496 . . . . 10.0 111.041 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -91.51 1.32 57.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.694 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.46 3.01 84.63 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.006 -0.838 . . . . 10.0 111.006 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.681 ' HB3' HG21 ' B' ' 43' ' ' THR . 38.1 m0 -57.07 108.96 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.315 -0.443 . . . . 10.0 112.152 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.2 tpp85 -87.5 105.52 17.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.132 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.527 ' HG2' HG23 ' B' ' 43' ' ' THR . 70.2 mttt -91.82 116.47 28.93 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.945 0.402 . . . . 10.0 110.465 179.323 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.434 ' HG2' HG23 ' B' ' 15' ' ' VAL . 57.2 mt-10 -134.51 146.87 50.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.069 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.8 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.4 tp -113.73 108.41 17.07 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -134.89 169.1 17.9 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.856 0.36 . . . . 10.0 110.736 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.535 ' HD3' ' CE1' ' B' ' 39' ' ' TYR . 14.3 ttp180 -108.94 115.63 30.44 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.615 HG12 ' HA ' ' B' ' 9' ' ' ILE . 25.5 m -125.14 161.74 28.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.751 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.2 p -96.56 123.82 40.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.319 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.02 110.06 2.01 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.292 -0.632 . . . . 10.0 109.292 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.427 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.44 26.95 16.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.479 0.656 . . . . 10.0 110.039 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 39.2 t0 63.27 25.46 14.74 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.623 -1.171 . . . . 10.0 110.839 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -78.85 0.56 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.767 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -99.08 122.59 51.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-O 120.697 0.284 . . . . 10.0 111.666 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.5 Cg_endo -80.14 126.97 6.56 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.922 2.414 . . . . 10.0 112.027 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.428 ' HD2' HG22 ' B' ' 56' ' ' THR . 18.1 ttmm -148.1 165.27 31.34 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' TYR . . . . . 0.535 ' CE1' ' HD3' ' B' ' 29' ' ' ARG . 7.0 m-85 -85.64 128.78 34.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.268 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 11.3 t0 -143.04 127.46 17.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.8 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.9 tt -105.47 123.28 59.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.442 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 4.8 mtp85 -143.12 -179.22 6.25 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.407 0.622 . . . . 10.0 112.373 -177.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.681 HG21 ' HB3' ' B' ' 23' ' ' TRP . 0.2 OUTLIER -123.73 136.72 54.61 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.263 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -122.5 166.39 14.86 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.624 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -69.69 152.52 96.14 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 10.0 109.953 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.02 -40.46 81.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.926 2.418 . . . . 10.0 113.0 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -84.98 -5.26 59.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 10.0 110.859 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 66.27 24.3 10.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.375 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -72.02 -38.93 69.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.823 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -138.5 174.55 10.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.467 0.651 . . . . 10.0 111.853 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.49 166.98 21.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.671 -1.15 . . . . 10.0 110.631 -178.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.2 -169.28 12.39 Favored Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.126 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -92.33 146.92 23.33 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.169 -0.606 . . . . 10.0 111.914 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.404 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -141.22 -125.31 2.1 Favored Glycine 0 N--CA 1.453 -0.221 0 N-CA-C 110.7 -0.96 . . . . 10.0 110.7 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.1 tt -151.93 139.47 13.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 117.684 0.742 . . . . 10.0 111.55 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.428 HG22 ' HD2' ' B' ' 38' ' ' LYS . 0.9 OUTLIER -98.54 141.47 31.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.887 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 76.5 mt -118.45 129.32 55.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.486 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.7 m -73.67 164.58 26.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -60.08 -48.21 82.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.467 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.426 ' O ' HG23 ' B' ' 64' ' ' VAL . 14.7 pt-20 -63.53 -41.0 98.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.041 0.448 . . . . 10.0 110.739 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -63.49 -53.22 55.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.918 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.41 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.8 t80 -61.08 -36.78 80.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.291 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.51 -52.7 50.97 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.204 -0.522 . . . . 10.0 112.102 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.426 HG23 ' O ' ' B' ' 60' ' ' GLU . 60.5 t -64.02 -43.22 97.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.043 0.449 . . . . 10.0 109.887 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.52 -52.7 62.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.569 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.51 ' HB3' HD11 ' A' ' 73' ' ' LEU . 44.0 mt -60.6 -49.57 77.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.462 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -50.09 -54.07 22.97 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 123.523 0.515 . . . . 10.0 111.363 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.65 ' HB3' HD12 ' A' ' 14' ' ' ILE . 6.3 mm-40 -69.19 -52.98 22.45 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.655 -178.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.595 ' HB3' HD22 ' A' ' 66' ' ' LEU . 61.0 mt -56.36 -44.57 80.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.98 -38.62 95.79 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.972 -0.633 . . . . 10.0 111.644 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' ASN . . . . . 0.468 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.1 t-20 -75.67 -23.07 56.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.806 0.336 . . . . 10.0 111.013 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.1 mmtt -69.83 -26.07 64.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.507 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.872 HD11 ' HB3' ' A' ' 66' ' ' LEU . 22.0 mt -84.85 -12.57 53.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.974 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 74' ' ' GLU . . . . . 0.468 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.9 mt-10 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.619 -0.705 . . . . 10.0 110.246 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 mmt . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.83 0.348 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.0 171.86 7.25 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.499 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 34.3 t70 -71.15 -50.61 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.9 -0.408 . . . . 10.0 109.9 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 45.8 mmtm -140.66 120.86 13.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.668 178.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.3 tp -92.87 138.74 31.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -72.03 128.71 36.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.459 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -156.11 163.17 39.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.483 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 6.7 tp10 -145.64 134.57 22.52 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.262 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.3 mt -84.3 110.36 18.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.402 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 41.2 mm -78.52 -47.62 23.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.763 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -162.32 134.62 5.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.905 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.62 137.26 37.76 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 72.2 mt -106.32 -75.94 0.62 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.157 -0.617 . . . . 10.0 111.44 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.612 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.5 mm -132.93 139.35 49.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -177.243 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.416 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -117.04 125.72 74.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 107.805 -1.183 . . . . 10.0 107.805 177.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.534 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.8 mt -95.66 -81.12 0.41 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.984 -0.686 . . . . 10.0 112.033 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 m -176.35 -165.18 0.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 17.9 mt-10 -117.43 143.73 45.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.855 0.36 . . . . 10.0 110.53 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -80.21 -176.68 5.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.678 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.57 -21.43 66.34 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.607 0.718 . . . . 10.0 110.711 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -87.23 -6.31 58.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.087 -0.961 . . . . 10.0 110.556 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.23 3.46 72.6 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.076 -0.81 . . . . 10.0 111.076 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.563 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.4 m0 -60.77 108.15 0.81 Allowed 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.742 -0.229 . . . . 10.0 111.345 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.8 tpp85 -84.05 100.26 10.98 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.642 ' HG2' HG22 ' A' ' 43' ' ' THR . 80.0 mttt -84.51 114.15 21.74 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.75 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.416 ' HG2' HG23 ' A' ' 15' ' ' VAL . 73.3 mt-10 -134.06 147.73 50.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.875 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.708 HD13 ' HB ' ' A' ' 41' ' ' ILE . 37.2 tp -115.34 110.56 19.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.232 -0.895 . . . . 10.0 108.623 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.57 159.31 40.84 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.051 0.453 . . . . 10.0 111.304 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -95.75 113.94 25.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.9 m -126.85 159.33 36.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.94 0.4 . . . . 10.0 110.868 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.3 p -96.8 123.72 40.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.471 179.243 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.5 m0 -63.62 108.64 1.44 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.489 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.3 m-80 59.61 28.93 18.45 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.107 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 63.67 26.9 14.7 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 114.927 -1.033 . . . . 10.0 111.229 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.88 -70.49 0.79 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.646 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 40.1 tt0 -95.12 112.83 59.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.573 -0.285 . . . . 10.0 111.726 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 6.3 Cg_exo -77.06 120.38 5.39 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.018 2.479 . . . . 10.0 110.909 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.577 ' HE3' HG21 ' A' ' 56' ' ' THR . 19.5 ttpt -148.89 166.55 28.23 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.733 -0.387 . . . . 10.0 110.61 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -90.26 134.48 34.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.64 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.57 132.97 18.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.708 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.9 tt -109.78 122.84 65.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 121.321 0.581 . . . . 10.0 109.802 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.2 mtt85 -144.9 179.73 7.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.197 -178.102 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.642 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -125.1 144.21 50.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.256 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -117.78 171.03 8.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.798 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 m -70.28 157.55 89.65 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.92 -29.22 88.91 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.248 1.965 . . . . 10.0 112.016 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -94.34 -1.07 54.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.811 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 61.78 27.01 16.47 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.127 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -76.81 -36.19 57.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.417 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -139.25 174.66 10.28 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.52 0.676 . . . . 10.0 112.304 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.93 172.93 12.28 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.337 -1.301 . . . . 10.0 110.302 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -143.09 -167.38 11.53 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 120.852 -0.69 . . . . 10.0 111.969 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -93.36 147.53 22.86 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.029 -0.689 . . . . 10.0 112.241 -179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.24 -117.89 1.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.576 -1.01 . . . . 10.0 110.576 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.29 141.27 15.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 117.348 0.574 . . . . 10.0 111.031 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.577 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.2 m -101.85 141.32 34.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.595 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.5 mt -119.28 129.41 54.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.164 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 t -79.5 168.35 19.56 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.854 -0.425 . . . . 10.0 109.854 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -58.39 -50.5 73.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.075 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.18 -41.91 98.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.041 0.448 . . . . 10.0 110.886 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.19 -54.02 44.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.016 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.691 ' CE2' HD11 ' A' ' 66' ' ' LEU . 33.1 t80 -56.78 -43.16 80.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.352 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.28 -52.5 52.89 Favored Glycine 0 CA--C 1.519 0.292 0 C-N-CA 121.327 -0.463 . . . . 10.0 113.155 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.73 -42.56 95.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.861 0.362 . . . . 10.0 110.482 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.456 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.4 tp -56.25 -51.35 68.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.804 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.703 HD22 ' HB3' ' B' ' 69' ' ' LEU . 21.5 mt -62.67 -46.61 87.37 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.467 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.9 tttm -50.83 -54.46 23.58 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.705 0.628 . . . . 10.0 111.352 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.579 ' CB ' HD12 ' B' ' 14' ' ' ILE . 9.2 mm-40 -66.9 -51.23 57.93 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.801 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 81.8 mt -57.5 -45.84 84.46 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.54 -39.37 97.56 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.884 -0.674 . . . . 10.0 111.767 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -68.6 -27.47 66.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.625 0.25 . . . . 10.0 111.142 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 75.3 mmtt -69.59 -28.71 66.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.866 0.365 . . . . 10.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' B' ' 66' ' ' LEU . 32.2 mt -89.67 -2.84 58.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.323 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.656 -179.608 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 23.7 mmt . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.834 0.35 . . . . 10.0 110.144 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.31 167.55 9.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.065 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.465 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 38.0 t70 -66.79 -54.33 23.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.141 0.496 . . . . 10.0 110.026 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.465 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 42.9 mmtm -139.44 118.07 12.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.349 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.8 tp -89.03 138.65 31.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.662 0.268 . . . . 10.0 110.494 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.0 tppt? -72.1 128.34 35.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.591 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -156.49 163.57 39.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.141 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -147.29 136.35 22.34 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.747 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -84.54 111.76 20.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.678 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.51 -45.33 23.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.176 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -165.47 131.53 2.66 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.478 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.4 139.95 41.15 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.527 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 70.0 mt -109.92 -73.69 0.68 Allowed 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.203 -0.599 . . . . 10.0 111.936 -178.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.579 HD12 ' CB ' ' A' ' 68' ' ' GLU . 16.4 mm -132.49 138.01 53.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.42 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.5 p -117.48 122.43 69.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 49.0 mt -93.25 -81.31 0.36 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.274 -0.57 . . . . 10.0 112.32 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.4 m -176.22 -166.45 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.562 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 48.6 mt-10 -117.91 140.24 49.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.684 0.278 . . . . 10.0 110.526 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -75.83 -176.01 3.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.057 -0.519 . . . . 10.0 109.927 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.9 -16.84 64.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.416 0.627 . . . . 10.0 110.785 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -91.84 -4.79 54.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.375 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.7 2.07 73.0 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.621 -0.8 . . . . 10.0 111.412 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.562 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.0 m0 -59.45 107.05 0.52 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 120.805 0.335 . . . . 10.0 111.537 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.6 tpp85 -82.96 100.2 10.27 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.655 ' HG2' HG22 ' B' ' 43' ' ' THR . 79.3 mttt -84.7 114.05 21.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.883 -179.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.42 ' HG2' HG23 ' B' ' 15' ' ' VAL . 64.8 mt-10 -135.22 147.4 49.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.681 . . . . 10.0 110.992 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.663 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.0 tp -114.4 110.76 20.38 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.258 -0.883 . . . . 10.0 108.906 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.73 158.94 42.03 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.038 0.446 . . . . 10.0 111.069 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -95.36 113.71 25.41 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 m -126.44 161.16 33.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.901 0.382 . . . . 10.0 110.778 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.479 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -98.52 124.24 43.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.565 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -64.08 108.13 1.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.573 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.403 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.07 29.5 19.06 Favored 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 123.783 0.677 . . . . 10.0 109.896 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 27.9 t70 63.19 22.11 13.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 114.615 -1.175 . . . . 10.0 111.299 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.14 -66.6 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.035 -0.415 . . . . 10.0 111.785 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.44 112.13 61.59 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.479 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 56.5 Cg_endo -77.18 120.19 5.27 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.219 1.946 . . . . 10.0 110.872 178.468 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.536 ' HE3' HG21 ' B' ' 56' ' ' THR . 16.9 ttpt -147.81 170.39 17.72 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.014 -0.274 . . . . 10.0 110.509 -178.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -93.55 133.52 36.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.673 -0.24 . . . . 10.0 110.686 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.409 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -147.11 132.2 18.28 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.663 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.7 tt -108.08 122.72 62.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.275 0.56 . . . . 10.0 109.907 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.409 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.6 mtt85 -145.33 177.15 9.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.377 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.655 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -122.14 144.09 49.15 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.29 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 38.2 m95 -118.01 171.66 7.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.71 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.1 m -70.8 158.06 88.85 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -59.61 -29.5 90.0 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.179 1.919 . . . . 10.0 111.691 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.96 -3.29 51.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.869 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 61.49 29.96 18.6 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.744 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.29 -34.6 31.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.166 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mmtm -137.56 174.28 10.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.321 0.581 . . . . 10.0 112.113 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.72 172.4 12.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.085 -178.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -141.95 -164.23 9.96 Favored Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.631 -0.795 . . . . 10.0 112.195 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -96.8 143.44 27.72 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.095 -0.65 . . . . 10.0 112.139 -179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.405 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -136.55 -118.49 1.76 Allowed Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 110.338 -1.105 . . . . 10.0 110.338 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -152.4 141.38 14.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 117.59 0.695 . . . . 10.0 110.926 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.536 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.2 m -100.47 142.29 32.14 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.673 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 71.6 mt -120.41 128.78 53.52 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.19 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -77.36 169.23 18.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.29 -48.43 81.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.632 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.607 ' O ' HG23 ' B' ' 64' ' ' VAL . 10.6 pt-20 -62.37 -44.3 96.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.055 0.455 . . . . 10.0 110.486 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -61.31 -54.11 48.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.614 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.413 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -58.05 -40.47 81.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.687 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.55 -51.55 58.15 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 116.024 -0.535 . . . . 10.0 112.552 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.607 HG23 ' O ' ' B' ' 60' ' ' GLU . 15.1 t -65.74 -44.67 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 120.801 0.334 . . . . 10.0 110.387 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.0 -51.75 65.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.919 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 73' ' ' LEU . 95.9 mt -60.48 -51.1 70.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.144 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.07 -57.61 5.58 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.758 0.661 . . . . 10.0 112.142 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.612 ' HB3' HD12 ' A' ' 14' ' ' ILE . 9.3 mm-40 -65.85 -50.39 64.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.068 -0.514 . . . . 10.0 112.146 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.703 ' HB3' HD22 ' A' ' 66' ' ' LEU . 78.6 mt -59.59 -44.97 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -178.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.69 -37.45 94.81 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.188 -0.529 . . . . 10.0 111.921 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -71.94 -27.34 62.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.818 0.342 . . . . 10.0 111.147 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.2 mmtt -66.07 -34.17 77.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.646 0.26 . . . . 10.0 111.051 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.469 HD11 ' CB ' ' A' ' 66' ' ' LEU . 23.6 mt -90.64 8.81 32.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.606 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.242 -0.885 . . . . 10.0 110.575 -180.0 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 CA-C-O 120.757 0.313 . . . . 10.0 110.895 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.3 158.2 16.78 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.076 -0.342 . . . . 10.0 110.076 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.408 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 7.1 t70 -61.53 -50.06 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 10.0 110.392 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 40.7 mmtm -136.47 100.45 4.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.48 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.9 tp -75.61 140.52 42.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.44 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.8 tppt? -75.75 136.14 40.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.91 0.386 . . . . 10.0 110.937 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -158.92 174.85 14.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.506 -0.553 . . . . 10.0 109.506 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.463 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.0 tp10 -156.58 129.13 7.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.732 -0.469 . . . . 10.0 109.732 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.461 ' HA ' HG12 ' A' ' 30' ' ' VAL . 61.1 mt -80.75 119.02 29.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.945 0.402 . . . . 10.0 110.625 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.9 mm -90.33 -48.63 14.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.287 0.565 . . . . 10.0 110.204 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -162.38 128.43 3.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.865 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -74.72 144.65 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.844 -0.799 . . . . 10.0 108.844 178.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 80.4 mt -114.1 -72.98 0.67 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.579 -0.448 . . . . 10.0 112.096 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.649 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.3 mm -131.37 140.58 48.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.472 . . . . 10.0 112.196 -177.666 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.1 120.07 57.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 177.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.7 mt -89.3 -80.27 0.3 Allowed 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.68 -0.408 . . . . 10.0 111.837 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 m -179.04 -166.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.679 . . . . 10.0 109.168 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.6 mp0 -112.91 144.04 43.16 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.273 0.358 . . . . 10.0 110.366 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -81.57 -173.78 4.6 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -21.74 66.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.674 0.749 . . . . 10.0 110.438 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -87.71 -5.61 58.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.059 -0.973 . . . . 10.0 110.534 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.11 4.26 74.86 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.692 -0.765 . . . . 10.0 111.303 -178.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.501 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -63.14 105.15 0.66 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.817 0.341 . . . . 10.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 43' ' ' THR . 8.1 tpp85 -83.71 100.13 10.69 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.446 178.666 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HG2' HG22 ' A' ' 43' ' ' THR . 88.8 mttt -82.94 114.95 21.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.112 0.482 . . . . 10.0 110.998 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -131.85 147.89 52.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.517 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.674 HD13 ' HB ' ' A' ' 41' ' ' ILE . 33.9 tp -118.19 109.5 16.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -133.25 161.76 33.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.026 0.441 . . . . 10.0 111.283 -178.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -96.27 113.96 25.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.153 -1.055 . . . . 10.0 108.153 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.461 HG12 ' HA ' ' A' ' 9' ' ' ILE . 16.8 m -129.75 158.53 42.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.698 0.285 . . . . 10.0 111.035 -178.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -95.92 124.85 40.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.001 0.429 . . . . 10.0 110.507 179.098 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -64.52 112.46 3.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.912 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.44 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 57.16 30.85 19.02 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.75 0.656 . . . . 10.0 110.579 -178.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.2 t70 63.02 30.22 16.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 114.708 -1.133 . . . . 10.0 111.096 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.17 -83.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.03 -0.419 . . . . 10.0 111.347 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -96.7 125.12 48.05 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.683 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.516 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.1 Cg_endo -77.93 132.7 11.93 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.726 2.284 . . . . 10.0 111.489 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -151.27 169.12 22.71 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -94.38 123.9 38.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.631 0.253 . . . . 10.0 110.406 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -137.27 129.96 30.16 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.674 ' HB ' HD13 ' A' ' 27' ' ' LEU . 8.8 tt -107.6 123.02 62.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.199 0.523 . . . . 10.0 109.896 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.1 mtt85 -145.23 179.44 7.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.343 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.558 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -124.3 145.55 49.33 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.953 179.426 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.438 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 44.5 m95 -117.52 170.85 8.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.07 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -69.98 158.22 87.84 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.76 -34.95 92.53 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.605 2.204 . . . . 10.0 112.541 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -91.21 -0.52 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.596 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.2 30.17 19.14 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.786 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -84.46 -33.76 23.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.949 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -136.42 174.68 10.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.537 0.685 . . . . 10.0 111.819 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.438 ' HB3' ' CE3' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -141.27 173.25 11.66 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.702 -177.932 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.58 -157.36 7.25 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.605 -0.807 . . . . 10.0 112.412 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mttm -96.14 151.01 19.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.496 -0.414 . . . . 10.0 111.934 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.26 -121.16 1.25 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.5 tt -152.75 141.79 14.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.407 0.603 . . . . 10.0 111.229 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.9 140.82 38.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.707 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.8 mt -121.15 135.22 55.2 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.398 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 m -76.46 164.31 26.1 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.907 -0.405 . . . . 10.0 109.907 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -58.97 -46.98 86.75 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.98 -44.75 94.29 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.136 0.493 . . . . 10.0 110.315 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.445 ' HB3' HD13 ' B' ' 16' ' ' LEU . 80.4 mt-10 -61.4 -52.05 66.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.746 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.693 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.0 t80 -56.77 -44.29 81.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.311 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.3 -47.73 89.64 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.344 -0.455 . . . . 10.0 112.72 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 92.9 t -68.45 -43.89 83.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.439 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.4 tp -56.35 -49.52 74.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.792 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.693 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.0 mt -64.27 -44.66 91.02 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 121.16 -0.216 . . . . 10.0 111.462 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.2 tttm -54.67 -50.3 68.54 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.477 0.486 . . . . 10.0 110.848 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.548 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 25.2 mm-40 -70.5 -48.76 54.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.425 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 47.8 mt -59.04 -44.2 91.76 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.17 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.06 -38.42 95.97 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.411 -0.9 . . . . 10.0 110.996 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -70.09 -25.25 63.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.35 -0.425 . . . . 10.0 110.941 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 29.5 mmmt -67.97 -28.84 67.79 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.039 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 28.7 mt -88.12 -7.8 56.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.876 0.37 . . . . 10.0 110.814 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.523 -0.751 . . . . 10.0 110.172 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 120.767 0.317 . . . . 10.0 110.5 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.48 155.93 19.52 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -60.69 -49.2 78.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 10.0 110.47 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -136.29 101.8 4.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 26.2 tp -77.74 139.45 39.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.7 tppt? -75.29 136.43 40.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.111 0.481 . . . . 10.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -160.47 171.73 18.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.31 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.414 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 10.5 tp10 -153.27 130.34 11.09 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.39 116.97 24.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.114 0.483 . . . . 10.0 110.805 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -88.32 -44.54 15.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.554 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -166.94 130.41 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.98 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.83 141.14 40.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 56.4 mt -113.16 -73.64 0.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.492 -0.483 . . . . 10.0 112.056 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.532 HD12 ' CB ' ' A' ' 68' ' ' GLU . 17.0 mm -128.84 139.43 51.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.1 0.476 . . . . 10.0 112.032 -177.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.8 p -124.44 120.69 59.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 61' ' ' GLU . 29.0 mt -91.11 -81.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.875 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -179.16 -166.35 0.09 Allowed 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.506 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -113.03 140.23 48.01 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.882 0.372 . . . . 10.0 110.829 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' ASN . . . . . 0.404 ' OD1' ' HE3' ' B' ' 25' ' ' LYS . 11.9 m120 -77.31 -174.63 3.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.177 178.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.18 -18.79 65.57 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.381 0.61 . . . . 10.0 110.599 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -90.37 -5.72 55.85 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.424 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.58 69.2 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 111.247 -0.741 . . . . 10.0 111.247 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.506 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -64.48 104.92 0.85 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.68 0.276 . . . . 10.0 111.373 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.544 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.7 tpp85 -83.12 101.34 11.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.448 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.559 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.4 mttt -84.29 116.81 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.2 0.524 . . . . 10.0 111.073 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -134.12 146.73 50.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.364 -0.835 . . . . 10.0 110.659 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.719 HD13 ' HB ' ' B' ' 41' ' ' ILE . 39.1 tp -116.63 111.25 19.6 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.2 159.27 42.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.086 0.469 . . . . 10.0 111.296 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -93.38 114.25 26.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 m -130.42 157.82 42.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.921 0.391 . . . . 10.0 111.036 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.515 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 0.1 OUTLIER -95.23 124.59 39.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.585 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -64.17 110.91 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.01 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.0 m-80 58.84 30.03 19.56 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 123.859 0.724 . . . . 10.0 110.473 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.8 t70 64.84 28.02 12.84 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.676 -1.147 . . . . 10.0 111.034 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.15 -83.28 0.59 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.018 -0.426 . . . . 10.0 111.746 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -96.03 122.48 58.14 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.658 -0.246 . . . . 10.0 111.509 -178.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.515 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.69 129.55 10.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.976 2.451 . . . . 10.0 111.866 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -148.13 169.79 19.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -94.99 122.53 37.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.404 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.409 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -136.48 131.79 34.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.719 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.4 tt -108.92 122.44 63.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.207 0.527 . . . . 10.0 110.02 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.409 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.3 mtt85 -144.89 -179.71 6.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.44 -177.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.559 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -125.25 145.91 49.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.066 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 45.9 m95 -117.84 171.25 8.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.182 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.3 m -70.34 157.93 88.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.9 -0.407 . . . . 10.0 109.9 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -56.07 -32.05 85.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.601 2.201 . . . . 10.0 112.728 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.94 -3.55 51.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.099 0.476 . . . . 10.0 110.263 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 31.82 12.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.973 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -86.34 -30.86 21.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.032 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -137.91 174.41 10.6 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.401 0.62 . . . . 10.0 111.893 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.38 173.07 11.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.883 -1.053 . . . . 10.0 110.324 -177.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.18 -157.24 7.39 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.226 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.42 147.13 26.7 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.033 -0.686 . . . . 10.0 111.967 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.98 -119.48 1.64 Allowed Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 110.724 -0.95 . . . . 10.0 110.724 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.5 tt -152.84 143.23 15.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 117.308 0.554 . . . . 10.0 111.005 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.46 140.46 38.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.85 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 48.2 mt -121.27 135.0 55.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.497 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.42 164.44 25.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.15 -0.477 . . . . 10.0 109.866 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -60.32 -44.86 95.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.43 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.479 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.1 pt-20 -63.35 -41.52 98.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.117 0.484 . . . . 10.0 110.637 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -64.07 -50.54 67.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.246 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.477 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -59.22 -41.41 88.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.406 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.23 -50.89 62.99 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.088 -0.577 . . . . 10.0 112.334 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 60' ' ' GLU . 47.6 t -66.12 -45.83 89.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.058 0.456 . . . . 10.0 110.413 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.5 tp -55.3 -49.72 71.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.629 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 76.9 mt -61.77 -47.47 85.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.943 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -54.4 -52.4 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.588 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.649 ' HB3' HD12 ' A' ' 14' ' ' ILE . 7.5 mm-40 -68.82 -50.08 53.11 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.551 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.634 ' HB3' HD22 ' A' ' 66' ' ' LEU . 46.9 mt -60.09 -44.45 94.78 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.674 0.25 . . . . 10.0 111.674 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.07 -35.76 91.93 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.306 -0.718 . . . . 10.0 111.306 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -75.04 -25.19 58.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.87 0.367 . . . . 10.0 110.756 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 23.5 mmmt -64.9 -30.82 71.84 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.179 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.487 HD11 ' CB ' ' A' ' 66' ' ' LEU . 26.7 mt -89.29 0.42 56.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.186 -179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.691 -0.671 . . . . 10.0 109.358 179.158 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 110.035 -0.358 . . . . 10.0 110.035 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.45 165.12 11.99 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.412 ' OD1' ' HG2' ' A' ' 4' ' ' LYS . 13.3 t70 -67.34 -58.71 4.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.156 0.503 . . . . 10.0 110.152 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.412 ' HG2' ' OD1' ' A' ' 3' ' ' ASP . 37.3 mmtm -132.79 104.67 6.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.757 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.39 141.18 41.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.774 0.321 . . . . 10.0 110.636 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -70.99 130.82 42.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.436 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.7 p90 -157.03 160.84 39.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.767 0.318 . . . . 10.0 110.934 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.474 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.7 tp10 -147.26 126.28 12.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.568 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.459 ' HA ' HG12 ' A' ' 30' ' ' VAL . 62.2 mt -82.69 106.12 13.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.15 0.5 . . . . 10.0 110.237 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.4 mm -76.49 -41.94 35.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.766 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -166.84 126.91 1.53 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.862 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -75.5 143.12 42.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 77.0 mt -110.01 -75.87 0.62 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.352 -0.539 . . . . 10.0 111.794 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.66 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.9 mm -128.49 137.34 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.53 . . . . 10.0 112.006 -177.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.411 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.5 p -119.83 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 177.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.539 HD22 ' HB ' ' B' ' 64' ' ' VAL . 32.0 mt -92.28 -80.92 0.35 Allowed 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.568 -0.453 . . . . 10.0 111.862 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.84 -168.72 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.527 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -110.34 147.76 33.29 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -83.27 -168.83 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.77 -21.45 65.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.548 0.69 . . . . 10.0 110.317 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -91.5 1.06 57.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.95 -1.023 . . . . 10.0 110.718 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.74 4.77 88.68 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.58 -0.819 . . . . 10.0 111.395 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.527 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.24 103.28 0.37 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.89 0.376 . . . . 10.0 110.994 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.533 ' O ' ' HA ' ' A' ' 43' ' ' THR . 11.3 tpp85 -83.8 100.69 11.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.571 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.564 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.0 mttt -83.4 115.12 21.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.066 0.46 . . . . 10.0 110.828 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.411 ' HG2' HG23 ' A' ' 15' ' ' VAL . 79.8 mt-10 -131.4 143.54 50.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.47 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.71 HD13 ' HB ' ' A' ' 41' ' ' ILE . 40.0 tp -112.43 108.29 17.39 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.157 -1.053 . . . . 10.0 108.157 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -131.54 160.64 34.66 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 10.0 111.213 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -97.11 113.73 25.33 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.501 -0.925 . . . . 10.0 108.501 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.459 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.5 m -127.46 157.0 39.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 120.928 0.394 . . . . 10.0 110.767 -179.252 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -95.95 125.81 40.76 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.176 178.993 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -64.62 110.21 2.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.959 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 60.66 27.53 17.25 Favored 'General case' 0 C--O 1.235 0.294 0 O-C-N 124.061 0.851 . . . . 10.0 110.624 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.6 t70 68.41 23.63 7.47 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.91 -1.041 . . . . 10.0 110.709 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.99 -84.67 0.54 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.102 -0.373 . . . . 10.0 111.666 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -91.63 123.27 64.05 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.516 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 62.8 Cg_endo -80.79 124.13 4.97 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.766 2.311 . . . . 10.0 111.808 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -143.08 170.03 16.47 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -96.1 126.57 41.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.684 0.278 . . . . 10.0 110.466 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.433 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -140.4 130.06 24.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.71 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.5 tt -106.55 124.32 61.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.354 0.597 . . . . 10.0 110.019 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.433 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.7 mtt85 -144.66 176.75 9.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.214 -177.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.564 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -123.63 142.11 51.36 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.796 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -117.58 170.66 8.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.932 -0.576 . . . . 10.0 109.616 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.11 159.08 73.59 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -57.81 -31.63 92.84 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.237 1.958 . . . . 10.0 111.773 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -91.57 -1.94 57.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.412 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 60.0 31.41 20.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.804 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -83.8 -33.14 25.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.165 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -135.74 174.88 10.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.366 0.603 . . . . 10.0 111.558 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.33 167.72 21.44 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.818 -1.083 . . . . 10.0 110.769 -177.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.11 -162.4 9.73 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.16 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -95.59 151.01 19.71 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.245 -0.562 . . . . 10.0 111.797 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.13 -125.43 1.61 Allowed Glycine 0 C--N 1.331 0.262 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.365 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.0 143.43 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.518 0.659 . . . . 10.0 111.259 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.92 140.06 39.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.572 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.4 mt -119.78 134.22 55.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.27 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.5 m -79.17 169.55 17.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.325 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.44 -49.8 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.707 0.262 . . . . 10.0 111.707 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -60.98 -43.47 98.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.548 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -61.03 -50.77 71.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.586 -0.733 . . . . 10.0 110.441 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.719 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.3 t80 -56.46 -45.84 80.66 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.239 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.89 -51.47 58.4 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.296 -0.478 . . . . 10.0 112.901 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.2 t -64.96 -42.69 95.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 10.0 110.664 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.7 tp -57.62 -51.83 67.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.807 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.719 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -62.84 -45.47 92.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.47 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -52.65 -51.37 60.42 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.208 0.528 . . . . 10.0 111.246 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 9.6 mm-40 -71.41 -47.49 55.66 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.809 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.513 ' HB3' HD22 ' B' ' 66' ' ' LEU . 48.4 mt -58.4 -44.46 88.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.574 0.226 . . . . 10.0 111.604 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.9 -40.41 99.24 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.577 -0.82 . . . . 10.0 111.143 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -68.53 -26.54 65.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.326 . . . . 10.0 110.728 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 68.3 mmtt -69.66 -27.04 64.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.022 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.445 HD11 ' HB3' ' B' ' 66' ' ' LEU . 35.7 mt -82.37 -25.46 33.78 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.073 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.618 -0.706 . . . . 10.0 110.465 -179.713 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.331 . . . . 10.0 110.223 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.36 171.33 8.64 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.439 ' OD1' ' HG2' ' B' ' 4' ' ' LYS . 13.1 t70 -74.22 -56.6 4.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.03 0.443 . . . . 10.0 110.059 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.439 ' HG2' ' OD1' ' B' ' 3' ' ' ASP . 41.9 mmtm -134.08 101.65 5.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.76 -0.654 . . . . 10.0 109.372 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 37.1 tp -74.56 137.79 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.151 -0.314 . . . . 10.0 110.151 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -70.33 128.56 36.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.785 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -153.5 163.35 40.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.392 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.463 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 11.5 tp10 -150.16 122.9 8.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.436 ' HA ' HG12 ' B' ' 30' ' ' VAL . 56.8 mt -79.07 109.9 14.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.144 0.497 . . . . 10.0 110.555 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.9 mm -79.13 -41.75 23.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.616 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -166.61 125.47 1.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.49 139.41 42.19 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 50.0 mt -108.46 -73.78 0.68 Allowed 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.385 -0.526 . . . . 10.0 112.294 -177.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.495 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.5 mm -128.01 132.22 68.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -177.003 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.414 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.8 p -115.77 122.37 69.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 177.042 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.1 mt -93.51 -80.83 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.754 -0.379 . . . . 10.0 111.84 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.8 m 178.94 -169.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.473 -0.565 . . . . 10.0 109.473 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.27 148.07 30.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.582 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -84.28 -171.92 3.88 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -18.69 65.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.383 0.611 . . . . 10.0 110.699 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -92.61 -3.32 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.606 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.82 4.13 76.03 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.418 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.514 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.2 m0 -62.06 104.01 0.43 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.747 0.308 . . . . 10.0 111.02 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.5 tpp85 -84.45 100.75 11.53 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 179.098 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.629 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.4 mttt -82.25 116.24 21.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.016 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.414 ' HG2' HG23 ' B' ' 15' ' ' VAL . 62.0 mt-10 -132.56 141.3 48.65 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.744 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.689 HD13 ' HB ' ' B' ' 41' ' ' ILE . 40.8 tp -110.79 108.11 17.84 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -131.78 159.14 39.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.936 0.398 . . . . 10.0 111.385 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -94.8 113.58 25.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' B' ' 9' ' ' ILE . 14.7 m -126.88 157.79 37.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.884 0.373 . . . . 10.0 110.773 -179.076 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.1 p -97.26 125.5 41.86 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.32 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -64.53 110.4 2.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.932 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 59.24 30.09 19.77 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.504 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 34.0 t70 66.48 20.85 10.87 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.512 -1.222 . . . . 10.0 111.142 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -87.4 0.45 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.803 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -89.87 122.4 67.96 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-O 120.658 0.266 . . . . 10.0 111.64 -178.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 59.5 Cg_endo -79.47 125.24 6.18 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.86 2.374 . . . . 10.0 111.954 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.423 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 20.1 ttmm -144.12 169.88 17.01 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' TYR . . . . . 0.423 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 3.2 m-85 -97.24 125.45 41.81 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.441 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.77 129.32 24.33 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.689 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.4 tt -105.12 124.08 59.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.249 0.547 . . . . 10.0 110.044 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.441 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.7 mtt85 -144.29 175.62 9.95 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.346 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.629 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -122.21 142.0 50.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.048 179.698 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -117.73 169.75 9.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.452 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 158.83 73.67 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -56.08 -34.55 93.02 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.153 1.902 . . . . 10.0 111.602 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -88.38 -4.19 58.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.555 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.72 34.93 19.81 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.349 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.68 -34.82 21.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.723 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -134.04 174.34 10.59 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.268 0.556 . . . . 10.0 111.568 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.89 167.79 21.02 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.607 -1.179 . . . . 10.0 110.4 -178.196 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.0 -161.46 9.42 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.955 -0.64 . . . . 10.0 112.387 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -96.75 148.28 23.05 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.432 -0.452 . . . . 10.0 111.57 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.86 -124.5 1.81 Allowed Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 111.323 -0.711 . . . . 10.0 111.323 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -148.21 142.23 19.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 117.499 0.65 . . . . 10.0 111.129 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.4 HG22 ' HD2' ' B' ' 38' ' ' LYS . 0.7 OUTLIER -103.88 139.01 39.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.918 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 133.16 56.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.477 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.7 m -78.26 170.6 16.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.25 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.32 -52.58 64.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.294 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.579 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.9 pt-20 -58.97 -42.36 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.098 0.475 . . . . 10.0 110.641 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -62.4 -50.19 72.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.667 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.544 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.2 t80 -57.65 -43.19 84.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.586 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.69 -51.77 56.58 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.36 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.579 HG23 ' O ' ' B' ' 60' ' ' GLU . 35.5 t -62.57 -45.84 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 10.0 110.422 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.6 tp -56.43 -53.29 59.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.373 -0.83 . . . . 10.0 110.721 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 32.4 mt -59.9 -48.8 80.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.249 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -52.2 -53.65 40.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.757 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.66 ' HB3' HD12 ' A' ' 14' ' ' ILE . 8.9 mm-40 -69.92 -48.53 58.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.973 -178.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.61 ' HB3' HD22 ' A' ' 66' ' ' LEU . 47.6 mt -59.12 -42.95 91.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.551 0.215 . . . . 10.0 111.418 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.12 -38.97 97.01 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.599 -0.81 . . . . 10.0 111.294 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' ASN . . . . . 0.448 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.9 t-20 -71.05 -27.46 63.66 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 10.0 110.915 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.0 mmtt -66.99 -26.03 66.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.367 -0.379 . . . . 10.0 111.553 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.525 HD11 ' CB ' ' A' ' 66' ' ' LEU . 23.1 mt -89.62 -13.6 36.75 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.546 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 74' ' ' GLU . . . . . 0.448 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 42.9 mt-10 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.632 -0.699 . . . . 10.0 110.3 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.7 mmm . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 120.916 0.389 . . . . 10.0 110.304 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.47 179.91 4.13 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.061 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -82.8 -60.73 2.08 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -131.13 94.64 3.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.068 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.16 139.46 50.22 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.801 0.334 . . . . 10.0 110.272 179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -71.75 137.46 47.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.957 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.6 p90 -161.44 172.15 16.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.934 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -155.44 138.13 15.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.436 ' HA ' HG12 ' A' ' 30' ' ' VAL . 54.8 mt -85.47 113.64 24.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.923 0.392 . . . . 10.0 110.335 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.07 -44.05 17.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.964 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -167.78 128.59 1.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.331 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -79.62 136.5 36.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.498 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 58.3 mt -106.99 -75.08 0.64 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.386 0.514 . . . . 10.0 112.386 -178.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.765 HD12 ' HB3' ' B' ' 68' ' ' GLU . 31.8 mm -127.07 140.93 47.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 112.596 0.591 . . . . 10.0 112.596 -177.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.454 HG23 ' HG2' ' A' ' 26' ' ' GLU . 5.1 p -121.2 123.22 69.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 177.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.416 HD22 ' HB ' ' B' ' 64' ' ' VAL . 31.1 mt -92.25 -81.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.542 -0.463 . . . . 10.0 111.572 -178.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -179.98 -174.8 0.28 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 122.748 0.419 . . . . 10.0 110.006 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.586 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 26.5 mp0 -111.12 156.81 20.81 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -102.99 -169.94 1.72 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.003 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.9 -23.43 67.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.391 0.615 . . . . 10.0 110.515 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -87.82 -4.66 58.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.511 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.03 3.56 87.61 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.759 -0.655 . . . . 10.0 112.063 -178.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.586 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 42.0 m0 -55.24 102.54 0.07 Allowed 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.373 0.269 . . . . 10.0 111.649 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.557 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.4 tpp85 -80.22 100.3 8.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.417 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 81.0 mttt -82.35 113.2 19.97 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.89 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.454 ' HG2' HG23 ' A' ' 15' ' ' VAL . 53.0 mt-10 -139.26 153.9 47.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.35 0.595 . . . . 10.0 111.743 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.741 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.5 tp -123.07 107.67 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.933 -1.03 . . . . 10.0 108.26 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -133.94 166.11 23.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.927 0.394 . . . . 10.0 110.88 -177.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.4 ttp180 -105.58 114.9 29.35 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.184 -0.673 . . . . 10.0 109.184 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.8 m -126.15 162.12 30.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.498 -179.134 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.427 ' HA ' ' O ' ' A' ' 36' ' ' GLU . 1.0 OUTLIER -99.29 123.12 43.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.948 0.404 . . . . 10.0 110.515 179.136 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 14.7 m0 -64.73 112.86 3.42 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.837 -0.619 . . . . 10.0 109.619 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 59.7 26.1 15.16 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.806 0.692 . . . . 10.0 110.207 -178.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t0 63.52 28.48 15.29 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.614 -1.176 . . . . 10.0 110.96 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.69 -74.66 0.61 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.068 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' A' ' 31' ' ' SER . 45.7 tt0 -91.01 118.09 68.34 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.526 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -82.58 120.79 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.601 2.201 . . . . 10.0 110.667 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -150.06 163.07 39.11 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.796 -0.362 . . . . 10.0 110.771 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -83.47 139.48 32.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.538 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -151.05 130.61 13.01 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.741 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -108.83 123.7 64.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.238 0.542 . . . . 10.0 110.111 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -149.1 174.4 12.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.222 -178.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.557 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 2.9 p -123.25 135.52 54.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 49.1 m0 -116.8 176.62 5.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.592 0.234 . . . . 10.0 110.693 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -66.86 153.64 93.71 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.406 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.41 -37.97 77.68 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.387 2.058 . . . . 10.0 111.561 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -83.76 -4.08 58.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.221 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 62.35 24.93 14.87 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.468 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -76.52 -31.73 57.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.973 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -140.07 174.13 10.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.33 0.586 . . . . 10.0 111.475 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.31 171.22 14.75 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.432 -178.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.15 -170.0 11.75 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.497 -0.859 . . . . 10.0 112.285 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -98.38 145.38 26.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.461 -0.435 . . . . 10.0 111.894 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.83 -111.87 0.85 Allowed Glycine 0 N--CA 1.453 -0.2 0 N-CA-C 110.952 -0.859 . . . . 10.0 110.952 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 tt -155.93 141.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 117.306 0.553 . . . . 10.0 110.803 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.2 m -98.44 141.67 31.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.139 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.3 mt -119.62 122.47 41.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.098 0.475 . . . . 10.0 110.543 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -80.93 168.34 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.578 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.13 -38.37 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.577 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.485 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -59.41 -47.84 83.92 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.388 178.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.485 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 29.5 mt-10 -66.96 -56.7 9.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.975 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.734 ' CE2' HD11 ' A' ' 66' ' ' LEU . 9.5 t80 -50.35 -45.84 55.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.437 -0.801 . . . . 10.0 111.956 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.1 -56.48 25.02 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.195 -0.526 . . . . 10.0 113.126 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.17 -43.53 91.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 10.0 111.14 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.0 tp -55.58 -51.61 66.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.973 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.751 HD22 ' HB3' ' B' ' 69' ' ' LEU . 20.5 mt -62.83 -45.47 92.45 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 121.002 -0.279 . . . . 10.0 111.121 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 ttpp -53.82 -52.63 59.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.89 -0.595 . . . . 10.0 111.005 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 15.8 mm-40 -69.69 -49.11 56.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.905 -178.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.9 mt -58.32 -44.78 88.81 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.624 0.25 . . . . 10.0 111.404 -179.162 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.24 -35.66 92.25 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.405 -0.902 . . . . 10.0 111.348 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -74.57 -18.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.867 0.365 . . . . 10.0 110.81 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 66.2 mmtt -75.19 -26.2 58.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.057 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' B' ' 66' ' ' LEU . 28.1 mt -90.1 -3.31 57.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.938 0.399 . . . . 10.0 110.565 179.088 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 118.481 -0.771 . . . . 10.0 110.336 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 90.3 mmm . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 120.878 0.37 . . . . 10.0 110.424 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.54 178.43 4.56 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.451 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -82.06 -58.25 3.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -131.79 94.04 3.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.226 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 27.4 tp -70.63 139.08 51.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.253 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -73.02 134.96 44.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 10.0 110.893 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -158.78 170.52 21.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.882 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.494 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.5 tp10 -153.08 134.35 14.22 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.41 ' HA ' HG12 ' B' ' 30' ' ' VAL . 52.2 mt -82.73 110.48 17.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.966 0.412 . . . . 10.0 110.413 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.4 mm -79.8 -48.61 20.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.635 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -164.96 129.46 2.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.229 -179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.93 144.51 36.78 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 57.8 mt -115.08 -70.75 0.78 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.231 -0.588 . . . . 10.0 112.433 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.551 HD12 ' HB3' ' A' ' 68' ' ' GLU . 15.3 mm -128.45 142.54 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.926 0.393 . . . . 10.0 111.847 -176.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.51 118.54 52.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.6 mt -88.23 -80.94 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -177.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 178.46 -172.24 0.13 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.596 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 24.0 mp0 -115.15 151.78 33.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.312 -0.403 . . . . 10.0 109.999 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' ASN . . . . . 0.401 ' HA ' HD22 ' B' ' 19' ' ' ASN . 3.3 m120 -96.82 -167.88 1.62 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -15.17 63.44 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.345 0.593 . . . . 10.0 110.601 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -94.41 -2.01 52.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.957 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.31 4.31 90.23 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.275 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.596 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.6 m0 -56.94 102.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.5 tpp85 -80.15 100.6 8.33 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.408 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 78.7 mttt -82.25 113.76 20.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.898 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -139.83 155.1 47.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.438 0.637 . . . . 10.0 111.747 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.717 HD13 ' HB ' ' B' ' 41' ' ' ILE . 37.3 tp -124.24 107.91 11.7 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.191 -1.04 . . . . 10.0 108.191 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -133.9 164.42 27.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.918 0.39 . . . . 10.0 110.927 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.1 ttp180 -104.13 114.3 28.44 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.4 m -125.25 162.1 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.748 -179.045 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.494 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -99.79 121.81 41.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.505 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 17.1 m0 -64.2 112.88 3.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.763 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 59.75 26.18 15.28 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.014 -178.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.0 t0 61.3 33.4 19.0 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 114.517 -1.22 . . . . 10.0 110.491 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.92 -70.05 0.81 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.064 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' B' ' 31' ' ' SER . 44.2 tt0 -94.92 117.58 66.83 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.601 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -81.64 120.16 3.47 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.372 2.048 . . . . 10.0 110.708 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 11.0 ttpt -150.24 163.23 38.81 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.804 -0.358 . . . . 10.0 110.708 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.88 138.51 32.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.347 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -150.04 130.5 13.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.717 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.2 tt -108.53 123.13 64.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.388 0.613 . . . . 10.0 110.14 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -149.03 175.47 11.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.574 -178.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.553 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 4.5 p -124.31 135.4 53.33 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.337 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -117.02 175.1 5.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.424 -0.213 . . . . 10.0 110.424 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.7 m -65.49 153.85 89.32 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.452 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.08 -34.97 89.07 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.424 2.083 . . . . 10.0 111.319 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.57 -4.75 59.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.049 -0.978 . . . . 10.0 110.23 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 61.98 23.81 14.08 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.783 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -76.7 -29.7 56.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -141.48 174.53 10.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.557 0.694 . . . . 10.0 111.953 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.15 171.8 13.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.32 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.72 -170.64 12.01 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.238 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.9 mttp -97.57 141.61 30.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.256 0.55 . . . . 10.0 112.426 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -138.57 -119.32 1.72 Allowed Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.386 -1.086 . . . . 10.0 110.386 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -149.43 143.14 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 117.27 0.535 . . . . 10.0 110.674 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 4.0 m -97.81 139.57 33.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.524 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -117.75 119.29 34.46 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.967 0.413 . . . . 10.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.7 166.93 21.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.314 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.0 -35.17 74.46 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.874 0.368 . . . . 10.0 110.922 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.452 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.9 pt-20 -61.75 -46.07 91.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.062 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.452 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 31.3 mt-10 -68.34 -57.21 6.27 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.863 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.5 t80 -52.15 -42.28 63.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.463 -0.789 . . . . 10.0 111.478 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.99 -55.52 30.43 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.875 -0.678 . . . . 10.0 112.954 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.416 ' HB ' HD22 ' A' ' 16' ' ' LEU . 19.1 t -68.66 -42.36 83.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.937 0.399 . . . . 10.0 110.865 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.0 tp -56.59 -50.93 70.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.021 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 60.1 mt -60.62 -50.69 72.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.726 0.298 . . . . 10.0 110.606 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 24.8 tttm -50.84 -53.04 35.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.8 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.765 ' HB3' HD12 ' A' ' 14' ' ' ILE . 30.6 mm-40 -69.4 -52.45 26.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.282 -178.151 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.751 ' HB3' HD22 ' A' ' 66' ' ' LEU . 62.4 mt -58.87 -43.13 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.91 -38.23 96.22 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.47 -0.872 . . . . 10.0 111.142 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 71' ' ' ASN . . . . . 0.408 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.4 t-20 -73.51 -20.06 60.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.504 -0.348 . . . . 10.0 111.359 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.8 mmtt -72.64 -27.51 62.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.658 0.266 . . . . 10.0 110.95 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.88 0.46 57.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.984 0.421 . . . . 10.0 111.019 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' GLU . . . . . 0.408 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.9 mt-10 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.789 -0.624 . . . . 10.0 109.892 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.756 0.312 . . . . 10.0 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.46 160.23 17.98 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -66.96 -53.4 32.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.236 -0.653 . . . . 10.0 109.236 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -139.98 95.23 2.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.195 -0.911 . . . . 10.0 109.697 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.5 tp -64.22 145.77 55.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.852 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.1 tppt? -79.25 136.48 37.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.47 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -164.32 163.53 22.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.189 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.458 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.8 tp10 -145.4 126.09 14.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.533 ' HA ' HG12 ' A' ' 30' ' ' VAL . 84.6 mt -73.83 110.77 8.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.002 0.429 . . . . 10.0 110.147 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mm -80.68 -48.89 19.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -162.96 126.65 2.88 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.042 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -78.39 144.31 36.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 68.7 mt -112.44 -75.46 0.61 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.565 -0.454 . . . . 10.0 111.625 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.566 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.0 mm -128.87 140.35 49.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.304 0.573 . . . . 10.0 112.49 -177.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.452 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.4 p -123.59 120.45 60.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 107.85 -1.167 . . . . 10.0 107.85 177.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.601 HD22 ' HB ' ' B' ' 64' ' ' VAL . 32.5 mt -89.72 -81.68 0.28 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.567 -0.453 . . . . 10.0 112.124 -177.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.2 m -174.51 -168.39 0.37 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -107.44 136.57 47.01 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.827 -0.435 . . . . 10.0 109.827 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -74.43 -173.83 1.85 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.793 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.06 68.45 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.614 0.721 . . . . 10.0 110.574 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -88.66 -1.07 57.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.811 -1.086 . . . . 10.0 110.91 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.36 1.62 81.01 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.125 -0.79 . . . . 10.0 111.125 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -59.06 106.05 0.38 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.838 0.351 . . . . 10.0 111.318 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.523 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.4 tpp85 -84.53 99.74 10.93 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.504 178.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.445 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.3 mttt -82.91 118.29 23.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.425 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.452 ' HG2' HG23 ' A' ' 15' ' ' VAL . 62.6 mt-10 -133.56 149.79 51.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.986 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 40.3 tp -117.76 108.11 14.97 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.612 -0.884 . . . . 10.0 108.612 178.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -135.63 160.97 36.85 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.791 0.329 . . . . 10.0 110.451 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 ttp180 -102.19 115.0 29.63 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.533 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.2 m -125.26 161.85 28.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.691 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.458 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.4 p -93.39 124.52 37.44 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -63.66 108.28 1.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.443 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 61.8 m-80 59.28 30.36 20.08 Favored 'General case' 0 CA--C 1.522 -0.108 0 O-C-N 123.869 0.73 . . . . 10.0 109.703 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 44.1 t0 62.91 26.69 15.67 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.365 -1.289 . . . . 10.0 111.09 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.26 -71.2 0.76 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.128 -0.357 . . . . 10.0 111.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -94.16 114.79 64.13 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.853 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 53.5 Cg_endo -78.27 119.9 4.74 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.164 1.909 . . . . 10.0 110.282 177.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.434 ' HE3' HG21 ' A' ' 56' ' ' THR . 20.7 ttpt -150.03 166.23 30.33 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.889 -0.324 . . . . 10.0 110.489 -178.158 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -87.01 132.16 33.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 10.0 110.867 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.415 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -144.8 132.96 21.57 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.49 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -109.88 121.83 63.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.356 0.598 . . . . 10.0 109.824 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.415 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.74 179.44 7.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.281 -177.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -128.05 146.01 50.81 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.197 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -117.23 178.16 4.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.938 -0.573 . . . . 10.0 109.783 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.404 ' HG ' ' H ' ' A' ' 50' ' ' LYS . 1.3 p -80.36 161.41 64.97 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -57.63 -29.78 86.46 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.368 2.045 . . . . 10.0 112.612 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -100.5 0.16 39.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.135 0.493 . . . . 10.0 110.323 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 59.14 34.19 23.16 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.219 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.14 -37.22 22.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.102 0.477 . . . . 10.0 110.327 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.404 ' H ' ' HG ' ' A' ' 45' ' ' SER . 43.5 mmtm -139.35 174.38 10.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.912 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.422 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -150.55 173.04 14.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.758 -177.957 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.42 -162.08 9.99 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.779 -0.724 . . . . 10.0 112.212 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -90.08 162.5 15.29 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.361 -0.493 . . . . 10.0 112.243 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -152.78 -121.63 0.89 Allowed Glycine 0 C--N 1.33 0.229 0 CA-C-N 115.248 -0.887 . . . . 10.0 111.277 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.2 tt -153.66 143.17 14.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 117.48 0.64 . . . . 10.0 110.969 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.434 HG21 ' HE3' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -105.01 145.73 30.03 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.955 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -125.94 132.11 52.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.007 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -75.36 161.61 29.12 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -57.12 -46.23 82.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.559 -179.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.49 -46.13 91.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.944 0.402 . . . . 10.0 110.585 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -59.52 -49.59 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.355 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.738 ' CE2' HD11 ' A' ' 66' ' ' LEU . 15.6 t80 -57.07 -43.84 82.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.22 -0.9 . . . . 10.0 111.356 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.43 -56.3 25.99 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.717 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.87 -41.28 88.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.912 0.387 . . . . 10.0 110.373 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.445 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 17.4 tp -58.2 -54.6 45.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.872 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.738 HD11 ' CE2' ' A' ' 62' ' ' PHE . 22.2 mt -62.44 -46.29 89.19 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.757 -0.201 . . . . 10.0 111.465 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 tttm -50.4 -49.98 53.03 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.603 0.564 . . . . 10.0 111.459 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 13.3 mm-40 -72.35 -48.67 40.11 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.414 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.475 ' HB3' HD22 ' B' ' 66' ' ' LEU . 84.1 mt -57.41 -44.98 85.04 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.144 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.05 98.75 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.686 -0.769 . . . . 10.0 111.372 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.469 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 13.1 t-20 -68.06 -28.31 67.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.955 0.407 . . . . 10.0 111.057 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.6 mmtt -67.41 -28.9 68.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.087 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.644 HD11 ' HB3' ' B' ' 66' ' ' LEU . 50.5 mt -89.68 -4.86 57.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.682 -0.236 . . . . 10.0 111.126 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 41.1 mt-10 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.42 -0.8 . . . . 10.0 110.722 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.865 0.364 . . . . 10.0 110.406 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.4 161.78 13.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.2 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.01 -51.81 29.3 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -139.98 94.51 2.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.212 -0.904 . . . . 10.0 109.313 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.3 tp -62.35 145.12 54.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.121 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -79.43 134.08 36.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.658 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -163.44 161.71 24.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.449 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -142.38 130.22 21.7 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.45 ' HA ' HG12 ' B' ' 30' ' ' VAL . 65.5 mt -78.26 105.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.939 0.4 . . . . 10.0 110.802 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 40.8 mm -75.99 -47.42 32.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.619 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -164.04 127.33 2.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.08 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -79.67 141.72 36.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.5 mt -112.09 -72.98 0.69 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.381 -0.528 . . . . 10.0 112.354 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.501 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.6 mm -127.81 140.39 49.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.107 0.48 . . . . 10.0 112.074 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -125.26 115.47 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -84.94 -82.19 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.207 0.447 . . . . 10.0 112.207 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.0 m -177.42 -167.9 0.17 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -107.03 138.25 43.55 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -76.93 -172.67 2.4 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.868 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.87 -13.92 62.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.41 0.624 . . . . 10.0 111.417 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -101.14 2.27 40.02 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.885 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 2.22 85.2 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.269 -178.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 41.1 m0 -59.93 106.06 0.46 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.975 0.417 . . . . 10.0 111.484 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.511 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.1 tpp85 -84.57 100.03 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.646 178.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -82.53 118.73 23.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.908 0.385 . . . . 10.0 110.486 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -133.54 148.32 51.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.93 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.553 HD13 ' HB ' ' B' ' 41' ' ' ILE . 41.4 tp -118.03 107.74 14.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.412 -0.959 . . . . 10.0 108.412 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -135.99 162.5 32.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.893 0.377 . . . . 10.0 110.743 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -103.2 114.83 29.44 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.4 m -123.85 162.2 25.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.46 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.1 p -93.91 123.41 37.25 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.865 -0.421 . . . . 10.0 109.865 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.21 108.01 1.18 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.7 m-80 60.05 29.26 18.84 Favored 'General case' 0 CA--C 1.523 -0.082 0 O-C-N 123.707 0.629 . . . . 10.0 109.773 -177.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t0 61.27 34.57 18.56 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.7 -1.136 . . . . 10.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.09 -71.61 0.72 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.083 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -91.77 114.58 62.41 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.385 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.411 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 39.3 Cg_endo -80.64 118.7 3.54 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.773 1.649 . . . . 10.0 109.964 178.056 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -148.23 166.62 27.39 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 110.217 -0.29 . . . . 10.0 110.217 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -87.56 132.79 33.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.583 -0.281 . . . . 10.0 110.666 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -145.57 132.07 19.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.99 -0.744 . . . . 10.0 108.99 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.553 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.3 tt -108.94 121.65 62.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.442 0.639 . . . . 10.0 109.915 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.423 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.2 mtt85 -144.11 179.88 6.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.307 -178.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -128.86 146.3 50.97 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.402 -179.762 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -117.56 176.66 5.07 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.941 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -77.64 161.15 72.94 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.211 -0.662 . . . . 10.0 109.211 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.41 -30.25 87.31 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.268 1.979 . . . . 10.0 112.16 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -97.14 -4.98 38.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.74 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 64.01 29.83 14.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.558 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -82.35 -37.31 25.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.111 0.481 . . . . 10.0 110.293 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -137.54 171.77 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.984 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' MET . . . . . 0.405 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -148.82 173.13 13.6 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.577 -178.068 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.86 -158.45 8.84 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.849 -0.691 . . . . 10.0 112.271 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -92.64 160.63 14.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.16 0.505 . . . . 10.0 112.307 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.405 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -152.31 -127.95 1.33 Allowed Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.654 -0.979 . . . . 10.0 110.654 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.5 tt -147.98 143.32 19.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 117.511 0.656 . . . . 10.0 111.24 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -103.67 145.02 30.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.685 -0.688 . . . . 10.0 111.132 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 81.5 mt -125.8 131.63 52.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.266 -0.424 . . . . 10.0 109.99 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -75.29 161.33 29.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.17 -47.0 82.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.702 0.287 . . . . 10.0 111.657 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.477 ' O ' HG23 ' B' ' 64' ' ' VAL . 12.1 pt-20 -62.17 -42.16 99.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.987 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -63.12 -48.72 77.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.868 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.528 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -59.29 -40.19 85.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.756 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.28 -56.06 27.3 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.176 -0.535 . . . . 10.0 112.625 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.601 ' HB ' HD22 ' A' ' 16' ' ' LEU . 8.1 t -62.16 -41.69 92.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.001 0.429 . . . . 10.0 110.486 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.3 tp -58.03 -54.48 46.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.048 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.644 ' HB3' HD11 ' A' ' 73' ' ' LEU . 51.1 mt -61.31 -48.45 81.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.577 -0.283 . . . . 10.0 111.219 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -49.57 -52.71 28.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.844 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 8.0 mm-40 -71.31 -48.22 51.9 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.958 -178.509 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.592 ' HB3' HD22 ' A' ' 66' ' ' LEU . 60.5 mt -58.57 -45.24 89.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.71 -0.223 . . . . 10.0 111.56 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.64 96.24 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.685 -0.769 . . . . 10.0 111.358 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 71' ' ' ASN . . . . . 0.553 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.6 t-20 -70.9 -26.61 63.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.931 0.396 . . . . 10.0 111.149 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.3 mmtt -68.28 -27.21 66.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.272 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.592 HD11 ' CB ' ' A' ' 66' ' ' LEU . 22.5 mt -90.9 -2.35 57.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.974 -0.29 . . . . 10.0 111.446 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 74' ' ' GLU . . . . . 0.553 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.4 mt-10 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.606 -0.711 . . . . 10.0 110.038 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.894 0.378 . . . . 10.0 110.572 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.78 161.83 16.47 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.85 -58.74 5.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.986 0.422 . . . . 10.0 110.291 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.12 93.48 3.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.004 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.78 141.16 58.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -74.25 132.39 42.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -156.77 166.19 34.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.958 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.435 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.7 tp10 -154.56 129.39 9.39 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -78.11 114.68 19.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.106 0.479 . . . . 10.0 110.147 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.7 mm -85.28 -41.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.171 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -169.42 127.73 0.97 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.685 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -75.28 143.94 42.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 85.2 mt -114.78 -73.7 0.64 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.349 -0.541 . . . . 10.0 111.626 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.671 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.7 mm -129.19 143.85 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 10.0 112.315 -177.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.428 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.7 p -128.24 123.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 108.205 -1.035 . . . . 10.0 108.205 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.588 HD22 ' HB ' ' B' ' 64' ' ' VAL . 35.4 mt -91.49 -81.37 0.33 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.263 -0.575 . . . . 10.0 111.5 -178.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -177.27 -171.87 0.36 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -104.1 133.46 49.01 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -73.5 -173.72 1.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.684 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.86 -30.63 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.72 0.771 . . . . 10.0 110.31 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -83.64 -2.14 55.48 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.544 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.02 2.28 81.08 Favored Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.406 -0.902 . . . . 10.0 110.947 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 40.9 m0 -60.03 105.57 0.41 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.981 0.42 . . . . 10.0 111.191 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.3 tpp85 -82.77 100.11 10.08 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.492 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.573 ' HG2' HG22 ' A' ' 43' ' ' THR . 86.9 mttt -80.92 115.09 20.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.435 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.428 ' HG2' HG23 ' A' ' 15' ' ' VAL . 60.9 mt-10 -133.09 154.25 50.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.998 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' HB ' ' A' ' 41' ' ' ILE . 36.1 tp -125.42 107.96 11.18 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -134.9 156.72 48.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.804 0.335 . . . . 10.0 110.899 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 29' ' ' ARG . 37.6 ttm180 -90.76 114.72 27.16 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.03 -0.73 . . . . 10.0 109.03 178.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.7 m -126.03 156.54 36.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.805 0.336 . . . . 10.0 110.763 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.8 p -94.45 122.94 37.54 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.933 0.397 . . . . 10.0 110.565 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -64.42 109.47 1.95 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.049 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.0 m-80 60.33 31.04 20.29 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.67 -0.696 . . . . 10.0 110.151 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.19 17.05 10.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.548 -1.205 . . . . 10.0 111.222 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.07 -97.79 0.28 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.446 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.78 124.48 85.04 Favored Pre-proline 0 C--O 1.234 0.247 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.9 Cg_endo -80.09 123.78 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.832 2.355 . . . . 10.0 111.456 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -142.27 167.23 22.59 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.738 -0.385 . . . . 10.0 110.169 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -92.36 128.74 38.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.127 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.443 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.7 t70 -141.69 130.45 22.89 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.64 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.4 tt -106.45 122.33 60.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 110.03 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.443 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.7 mtt85 -144.87 -178.35 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.105 -177.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.573 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -127.68 142.4 51.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.817 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -117.47 175.06 5.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 10.0 109.783 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.53 159.67 71.53 Favored Pre-proline 0 C--N 1.32 -0.703 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -59.58 -28.38 87.28 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.347 2.032 . . . . 10.0 111.981 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -93.43 -5.51 49.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.126 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.12 31.61 21.43 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.563 -179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 50' ' ' LYS . 13.5 pt-20 -81.74 -40.0 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.531 -0.759 . . . . 10.0 110.927 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.418 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 44.8 mmtm -140.24 173.64 11.31 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.82 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.421 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -148.38 172.23 14.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.708 -177.755 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -130.51 -154.65 8.05 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.708 -0.758 . . . . 10.0 112.232 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -100.46 155.23 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.253 -0.557 . . . . 10.0 112.221 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.6 -120.27 1.23 Allowed Glycine 0 CA--C 1.518 0.246 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.921 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -150.52 142.66 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 117.564 0.682 . . . . 10.0 111.275 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.28 146.01 29.41 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.771 -0.65 . . . . 10.0 111.011 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.7 mt -131.55 127.18 36.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 m -80.26 171.61 14.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.699 0.285 . . . . 10.0 111.194 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -52.16 -59.43 4.38 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -59.52 -45.58 91.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.622 0.249 . . . . 10.0 111.641 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -59.86 -50.18 74.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 10.0 110.7 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.681 ' CE2' HD11 ' A' ' 66' ' ' LEU . 39.9 t80 -62.18 -41.68 98.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.397 -0.819 . . . . 10.0 111.215 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.77 57.22 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 116.069 -0.514 . . . . 10.0 112.913 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.43 -41.68 93.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.903 0.383 . . . . 10.0 110.226 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.522 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -57.31 -52.27 66.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.45 179.486 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.681 HD11 ' CE2' ' A' ' 62' ' ' PHE . 18.1 mt -62.38 -45.21 94.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.733 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -51.99 -50.13 61.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.172 -179.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 5.5 mm-40 -72.71 -46.31 54.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.664 -179.08 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 60.9 mt -58.34 -45.34 88.3 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.8 0.333 . . . . 10.0 111.575 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.38 -39.86 98.24 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 111.166 -0.774 . . . . 10.0 111.166 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 18.0 t-20 -67.22 -29.82 69.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.994 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.4 mmtt -68.12 -27.3 66.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.735 0.302 . . . . 10.0 110.731 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.586 HD11 ' HB3' ' B' ' 66' ' ' LEU . 25.5 mt -89.47 -8.45 52.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.039 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.457 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 33.4 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.62 -0.705 . . . . 10.0 110.029 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 CA-C-O 120.918 0.389 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.49 165.17 11.33 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.757 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -69.06 -58.95 3.41 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -133.42 94.71 3.36 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 28.7 tp -65.93 140.94 58.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.25 179.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -75.28 131.14 40.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.398 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -154.5 168.47 26.61 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.266 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.476 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.6 tp10 -155.86 128.2 7.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.8 mt -78.13 110.83 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.492 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 25.7 mm -80.92 -42.46 20.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.479 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -169.34 126.85 0.94 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.434 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -74.84 144.41 43.46 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 68.0 mt -115.8 -72.85 0.67 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.447 -0.501 . . . . 10.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.565 HD12 ' CB ' ' A' ' 68' ' ' GLU . 22.4 mm -127.86 142.93 42.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.281 0.562 . . . . 10.0 112.144 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.438 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.6 p -126.8 126.38 68.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 107.801 -1.185 . . . . 10.0 107.801 177.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 52.2 mt -93.91 -81.56 0.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.687 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.27 -172.31 0.3 Allowed 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.435 -0.579 . . . . 10.0 109.435 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -104.46 129.35 52.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -70.59 -174.92 0.95 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.998 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.83 -27.9 69.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.356 0.598 . . . . 10.0 110.841 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -88.42 0.7 55.95 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.78 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.36 2.04 83.2 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.117 -0.793 . . . . 10.0 111.117 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -60.0 105.51 0.4 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.001 0.429 . . . . 10.0 111.445 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.502 ' O ' ' HA ' ' B' ' 43' ' ' THR . 11.7 tpp85 -81.7 100.8 9.68 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.769 178.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.587 ' HG2' HG22 ' B' ' 43' ' ' THR . 82.2 mttt -81.08 116.85 21.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.625 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.438 ' HG2' HG23 ' B' ' 15' ' ' VAL . 62.9 mt-10 -135.31 152.87 51.9 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.978 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.688 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.4 tp -125.34 108.05 11.3 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -134.84 156.0 49.67 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.112 -177.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.43 ' HD2' HH11 ' B' ' 29' ' ' ARG . 39.5 ttm180 -89.59 114.57 26.18 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 m -125.78 156.41 35.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.775 0.321 . . . . 10.0 110.455 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.476 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.0 OUTLIER -94.09 124.28 38.01 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.362 179.184 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -65.16 109.66 2.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 10.0 109.934 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 60.93 30.98 19.95 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.151 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 66.36 22.07 10.85 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.801 -1.09 . . . . 10.0 110.778 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.08 -96.86 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.419 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -78.66 122.85 85.35 Favored Pre-proline 0 C--O 1.234 0.24 0 CA-C-O 120.845 0.355 . . . . 10.0 111.854 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.7 Cg_endo -79.66 124.02 5.56 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.913 2.409 . . . . 10.0 111.255 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -143.45 169.03 18.45 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.02 -0.363 . . . . 10.0 110.02 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.29 128.97 41.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.429 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -141.69 129.33 21.53 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.688 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.6 tt -105.23 122.81 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 10.0 110.084 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.429 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -145.04 -178.6 6.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.239 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.587 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -128.09 142.67 51.14 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 109.942 179.561 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -117.6 174.15 6.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.837 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.83 159.55 76.11 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.95 -26.6 82.81 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.332 2.021 . . . . 10.0 111.954 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -95.12 -5.52 43.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.037 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.84 31.35 20.72 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.538 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.444 ' HG3' ' N ' ' B' ' 50' ' ' LYS . 11.5 pt-20 -81.49 -39.76 24.28 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.893 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 50' ' ' LYS . . . . . 0.444 ' N ' ' HG3' ' B' ' 49' ' ' GLU . 39.1 mmtm -139.43 173.05 11.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.808 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 51' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -146.78 172.38 13.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.524 -177.975 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.17 -154.69 7.94 Favored Glycine 0 C--O 1.228 -0.278 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.34 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 53' ' ' LYS . . . . . 0.403 ' HA ' ' NH2' ' B' ' 42' ' ' ARG . 42.1 mttp -101.08 150.49 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 122.298 -0.531 . . . . 10.0 112.264 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.51 -123.14 1.88 Allowed Glycine 0 C--N 1.332 0.311 0 N-CA-C 110.595 -1.002 . . . . 10.0 110.595 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -147.93 142.59 19.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 117.653 0.726 . . . . 10.0 111.065 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 140.76 37.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.338 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 52.4 mt -126.2 126.79 44.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.095 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m -78.68 173.86 12.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.831 0.348 . . . . 10.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -57.16 -56.73 18.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.105 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.562 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.7 pt-20 -61.16 -44.17 97.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.651 0.262 . . . . 10.0 111.494 -179.398 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -62.77 -48.05 80.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.015 0.436 . . . . 10.0 110.749 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -64.64 -38.58 91.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.436 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.84 -53.66 44.42 Favored Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.117 -0.492 . . . . 10.0 112.549 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.588 ' HB ' HD22 ' A' ' 16' ' ' LEU . 20.5 t -61.42 -43.33 96.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 10.0 110.047 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.4 tp -57.26 -52.48 65.15 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.615 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.586 ' HB3' HD11 ' A' ' 73' ' ' LEU . 80.9 mt -59.32 -51.51 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.18 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.1 tttm -48.52 -52.09 24.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.873 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.671 ' HB3' HD12 ' A' ' 14' ' ' ILE . 14.5 mm-40 -71.15 -48.12 53.78 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.951 -178.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.681 ' HB3' HD22 ' A' ' 66' ' ' LEU . 55.9 mt -58.89 -44.55 91.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.98 -41.11 99.64 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.924 -0.87 . . . . 10.0 110.924 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 12.0 t-20 -67.08 -30.0 69.92 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.909 0.385 . . . . 10.0 111.258 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.604 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.7 mmtt -65.13 -31.34 72.48 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.312 -0.242 . . . . 10.0 111.146 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.536 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.5 mt -90.12 -5.85 56.06 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.718 -0.393 . . . . 10.0 111.642 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 74' ' ' GLU . . . . . 0.457 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 28.1 mt-10 . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.622 -0.704 . . . . 10.0 110.47 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.941 0.4 . . . . 10.0 110.177 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.76 162.53 13.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.9 -53.0 14.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -133.93 94.8 3.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.006 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 21.9 tp -67.73 144.4 55.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.605 178.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -77.58 133.4 38.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.701 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -161.1 172.91 15.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.479 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.6 133.96 11.65 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.42 ' HA ' HG12 ' A' ' 30' ' ' VAL . 65.1 mt -83.8 107.9 15.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 120.985 0.421 . . . . 10.0 110.031 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.2 mm -76.0 -45.85 35.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -165.23 131.18 2.7 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.632 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.21 144.63 34.22 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 83.1 mt -113.7 -74.63 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.279 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.681 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.0 mm -132.1 139.15 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.246 0.546 . . . . 10.0 112.171 -177.6 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -120.17 122.21 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.851 -1.166 . . . . 10.0 107.851 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.489 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.0 mt -89.03 -80.67 0.29 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.533 -0.467 . . . . 10.0 111.917 -177.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 m 179.2 -169.41 0.1 Allowed 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.414 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 32.9 mp0 -106.45 146.27 30.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.263 179.516 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -87.86 -170.39 2.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.27 -24.56 67.7 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.532 0.682 . . . . 10.0 110.71 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -93.9 3.28 55.61 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.061 -0.972 . . . . 10.0 110.757 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.75 8.08 86.47 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.8 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.414 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -60.82 103.97 0.31 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.755 0.312 . . . . 10.0 111.5 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.513 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.1 tpp85 -81.58 99.26 8.74 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.469 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.6 mttt -85.37 117.82 24.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.918 0.39 . . . . 10.0 110.612 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG2' HG23 ' A' ' 15' ' ' VAL . 48.6 mt-10 -135.12 153.71 51.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.529 -0.759 . . . . 10.0 111.123 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.544 HD13 ' HB ' ' A' ' 41' ' ' ILE . 34.9 tp -123.16 107.23 11.5 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -135.79 154.96 51.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.315 -178.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -91.24 115.05 27.71 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.5 m -123.85 160.43 27.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.696 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.479 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -97.29 122.83 40.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.349 179.059 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.5 m0 -63.64 110.97 2.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.898 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.457 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 58.36 30.29 19.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.41 0.624 . . . . 10.0 110.18 -178.371 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.9 t70 62.53 29.64 17.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.802 -1.09 . . . . 10.0 111.028 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.7 -74.98 0.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 O-C-N 122.103 -0.373 . . . . 10.0 111.49 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.51 112.69 50.04 Favored Pre-proline 0 C--N 1.328 -0.357 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.422 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.8 Cg_endo -80.45 120.18 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.392 2.061 . . . . 10.0 110.714 178.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttpt -152.35 172.22 16.8 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.843 -0.343 . . . . 10.0 110.482 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -91.06 134.94 34.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.675 0.274 . . . . 10.0 111.262 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -146.88 130.45 16.85 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.544 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.6 tt -107.14 123.45 62.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.283 0.563 . . . . 10.0 110.194 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.4 ' HG2' ' HA3' ' A' ' 54' ' ' GLY . 3.1 mtt85 -146.32 179.28 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.34 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.513 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -126.82 145.11 50.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.147 179.668 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -117.4 173.5 6.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.457 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -76.69 156.57 82.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.17 -33.08 95.24 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.396 2.064 . . . . 10.0 112.943 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -97.27 2.85 51.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.811 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 56.99 41.68 27.31 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.266 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.78 -37.21 14.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.622 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -142.21 174.36 10.68 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.019 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.68 172.43 13.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.458 -0.792 . . . . 10.0 111.234 -177.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -134.74 -165.89 10.98 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 121.182 -0.533 . . . . 10.0 111.917 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.6 mttp -94.53 156.16 16.58 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.024 -0.692 . . . . 10.0 111.988 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.4 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.67 -130.76 1.76 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.017 -0.833 . . . . 10.0 111.017 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 tt -144.23 143.72 23.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 117.723 0.761 . . . . 10.0 111.44 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.73 144.2 31.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.966 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -125.01 131.53 53.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.379 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.94 162.92 25.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.553 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.9 -51.7 66.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -178.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.06 -44.68 97.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.777 0.323 . . . . 10.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.452 ' HB3' HD13 ' B' ' 16' ' ' LEU . 79.8 mt-10 -62.19 -45.72 92.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.448 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.685 ' CE2' HD11 ' A' ' 66' ' ' LEU . 29.2 t80 -61.39 -42.61 99.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.019 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.48 -53.76 43.46 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.394 -0.432 . . . . 10.0 112.457 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.5 t -59.97 -41.63 86.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.986 0.422 . . . . 10.0 110.262 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.1 tp -59.97 -53.98 51.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.713 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.685 HD11 ' CE2' ' A' ' 62' ' ' PHE . 17.3 mt -60.89 -46.88 88.88 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.637 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.6 tttm -49.93 -55.28 15.06 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.735 0.647 . . . . 10.0 111.43 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.493 ' CB ' HD12 ' B' ' 14' ' ' ILE . 26.2 mm-40 -68.9 -45.45 70.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.736 -0.666 . . . . 10.0 111.788 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 67.4 mt -59.17 -45.41 91.08 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.898 0.38 . . . . 10.0 111.434 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.78 -36.74 93.77 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.932 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.413 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 6.8 t-20 -74.37 -28.48 61.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.807 0.337 . . . . 10.0 110.919 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.6 mmtt -66.86 -28.43 68.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.898 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.553 HD11 ' HB3' ' B' ' 66' ' ' LEU . 31.4 mt -85.4 -2.38 58.04 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.773 0.286 . . . . 10.0 111.773 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.413 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 46.9 mt-10 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.507 -0.759 . . . . 10.0 110.831 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 120.881 0.372 . . . . 10.0 110.116 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.28 163.17 13.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -75.54 -47.91 24.77 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -136.9 94.0 2.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.832 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.9 tp -67.64 143.05 56.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.592 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.517 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.7 tppt? -78.16 131.7 37.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.649 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -159.49 174.43 14.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.843 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -156.56 133.19 10.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.411 ' HA ' HG12 ' B' ' 30' ' ' VAL . 54.3 mt -83.59 104.17 11.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.16 0.505 . . . . 10.0 110.582 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.5 mm -71.8 -50.29 39.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.504 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -159.99 128.19 4.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.232 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -75.54 145.46 41.25 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 93.6 mt -116.61 -70.94 0.76 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.248 -0.581 . . . . 10.0 111.892 -179.369 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.493 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.2 mm -133.46 140.4 46.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.09 0.472 . . . . 10.0 111.654 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.88 119.82 57.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 107.589 -1.263 . . . . 10.0 107.589 177.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' LEU . . . . . 0.452 HD13 ' HB3' ' A' ' 61' ' ' GLU . 35.5 mt -86.51 -81.42 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.453 -0.499 . . . . 10.0 111.971 -177.435 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.54 -168.5 0.15 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.459 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 30.1 mp0 -108.97 142.06 40.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 178.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -82.57 -169.72 2.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.908 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.84 65.75 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.326 0.584 . . . . 10.0 111.012 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 24.8 mttt -94.35 4.24 54.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.088 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.85 5.86 88.97 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.752 -0.737 . . . . 10.0 111.823 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.459 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -59.36 106.1 0.41 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.726 0.298 . . . . 10.0 111.452 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -83.58 99.76 10.38 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.491 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.5 mttt -84.95 117.71 24.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 110.818 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -134.76 154.05 51.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.949 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.658 HD13 ' HB ' ' B' ' 41' ' ' ILE . 46.7 tp -123.96 107.41 11.31 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 178.058 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -135.52 152.54 51.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.175 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -88.83 114.47 25.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' B' ' 9' ' ' ILE . 11.3 m -123.07 161.63 24.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.661 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.51 123.94 41.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.89 0.376 . . . . 10.0 110.246 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -64.07 109.4 1.81 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.839 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.7 m-80 59.46 30.23 19.88 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.109 -178.243 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.6 t70 63.53 29.55 15.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.994 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -122.58 -71.76 0.71 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.491 -0.322 . . . . 10.0 111.786 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -89.18 112.58 52.0 Favored Pre-proline 0 C--N 1.329 -0.316 0 N-CA-C 111.887 0.328 . . . . 10.0 111.887 -178.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -79.8 119.65 4.07 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.017 1.811 . . . . 10.0 110.562 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -151.42 173.5 14.48 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.719 -0.392 . . . . 10.0 110.171 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -93.28 135.52 34.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.57 0.224 . . . . 10.0 111.159 -179.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -147.44 129.81 15.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.658 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.8 tt -105.7 123.29 60.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.247 0.546 . . . . 10.0 110.115 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.413 ' HG2' ' HA3' ' B' ' 54' ' ' GLY . 3.5 mtt85 -146.11 178.75 7.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.418 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.499 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -126.16 145.15 50.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.984 179.957 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -117.76 174.13 6.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.186 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 156.26 82.38 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 178.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.77 -36.42 98.55 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.433 2.088 . . . . 10.0 112.662 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.34 1.81 56.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.028 0.442 . . . . 10.0 110.697 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.59 44.99 20.03 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.11 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -93.5 -37.55 11.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.622 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -140.25 173.4 11.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.333 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.86 170.74 15.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.985 -1.007 . . . . 10.0 110.819 -178.057 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.54 -165.95 11.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.127 -0.559 . . . . 10.0 111.762 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.6 151.94 18.91 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.139 -0.624 . . . . 10.0 111.872 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.413 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -146.58 -133.13 2.43 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.176 -0.92 . . . . 10.0 110.83 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -142.22 145.36 23.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 117.498 0.649 . . . . 10.0 111.478 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -103.55 144.92 30.78 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.353 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.51 130.28 51.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.244 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -77.95 163.43 25.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -56.62 -52.73 63.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.542 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.8 pt-20 -58.98 -44.37 91.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 10.0 111.157 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -63.95 -45.37 89.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.706 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.457 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.9 t80 -63.21 -39.69 95.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.328 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.87 -52.39 53.22 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.304 179.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 60' ' ' GLU . 21.5 t -60.87 -43.97 96.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.088 0.471 . . . . 10.0 109.933 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.93 -55.53 33.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.917 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.553 ' HB3' HD11 ' A' ' 73' ' ' LEU . 52.5 mt -57.98 -50.74 72.34 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.354 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -49.38 -55.13 13.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.022 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.681 ' HB3' HD12 ' A' ' 14' ' ' ILE . 36.6 mm-40 -69.05 -45.85 69.33 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.88 -178.453 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.66 ' HB3' HD22 ' A' ' 66' ' ' LEU . 71.7 mt -60.88 -44.23 97.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.813 0.339 . . . . 10.0 111.648 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.32 -37.53 94.74 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.735 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 71' ' ' ASN . . . . . 0.485 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.3 t-20 -73.3 -31.47 64.05 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.843 0.354 . . . . 10.0 110.765 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.3 mmtt -64.09 -25.88 68.3 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.55 0.574 . . . . 10.0 112.55 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.653 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.0 mt -90.42 4.94 49.53 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.829 -0.348 . . . . 10.0 111.689 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 74' ' ' GLU . . . . . 0.485 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.7 mt-10 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.325 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 CA-C-O 120.845 0.355 . . . . 10.0 110.558 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.64 168.53 9.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.194 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -64.74 -58.35 6.49 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -136.75 110.69 8.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.066 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.0 tp -80.38 133.12 35.87 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.431 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.0 tppt? -67.65 133.79 49.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.829 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -158.1 168.03 28.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.42 . . . . 10.0 109.919 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 12.3 tp10 -149.19 125.54 10.86 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.886 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 30' ' ' VAL . 61.4 mt -79.31 106.08 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.55 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.6 mm -72.06 -46.08 60.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.01 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.81 132.57 1.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.651 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -75.93 145.12 40.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.969 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 79.5 mt -112.65 -74.79 0.62 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.662 -0.415 . . . . 10.0 111.635 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.682 HD12 ' HB3' ' B' ' 68' ' ' GLU . 30.6 mm -132.37 137.37 54.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.767 0.655 . . . . 10.0 112.767 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.417 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.0 p -118.85 125.36 74.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.504 HD22 ' HB ' ' B' ' 64' ' ' VAL . 30.1 mt -94.18 -81.32 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 10.0 112.073 -177.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.0 m -172.88 -168.36 0.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.77 -0.456 . . . . 10.0 109.77 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.515 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 2.2 mp0 -112.37 135.06 53.52 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.429 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -73.27 -173.67 1.4 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.75 0.31 . . . . 10.0 110.728 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.82 -20.79 66.59 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.611 0.72 . . . . 10.0 109.896 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -91.1 -1.81 57.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.767 -1.106 . . . . 10.0 110.522 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 1.19 85.99 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.987 -0.845 . . . . 10.0 110.987 -178.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.515 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.2 m0 -60.27 108.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.82 0.343 . . . . 10.0 111.606 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' A' ' 43' ' ' THR . 6.8 tpp85 -86.93 99.61 11.99 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.407 178.545 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.625 ' HG2' HG22 ' A' ' 43' ' ' THR . 86.2 mttt -83.05 118.54 23.6 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.07 0.462 . . . . 10.0 110.587 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.417 ' HG2' HG23 ' A' ' 15' ' ' VAL . 60.1 mt-10 -133.52 145.17 49.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.853 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.716 HD13 ' HB ' ' A' ' 41' ' ' ILE . 40.7 tp -115.38 107.86 15.77 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -133.77 159.1 41.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.933 0.397 . . . . 10.0 110.958 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -94.08 114.09 26.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 9' ' ' ILE . 17.1 m -127.31 158.77 38.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.896 0.379 . . . . 10.0 110.821 -179.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.495 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -98.41 125.53 43.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.958 0.409 . . . . 10.0 110.475 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -64.23 108.95 1.71 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.843 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 61.19 25.66 15.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.027 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.9 t70 66.89 21.81 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.794 -1.093 . . . . 10.0 110.437 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.12 -75.92 0.61 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.281 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -98.89 120.74 57.94 Favored Pre-proline 0 C--N 1.329 -0.292 0 N-CA-C 111.776 0.287 . . . . 10.0 111.776 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.3 Cg_endo -79.45 120.81 4.53 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.861 2.374 . . . . 10.0 111.477 178.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.9 ttmm -143.52 168.49 19.74 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -92.02 129.5 37.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.596 0.236 . . . . 10.0 110.694 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.451 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -141.83 132.46 25.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.716 ' HB ' HD13 ' A' ' 27' ' ' LEU . 8.8 tt -110.78 121.21 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.239 0.542 . . . . 10.0 110.048 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.451 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.8 mtt85 -143.23 -178.74 6.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.446 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.625 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -125.61 143.02 51.21 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.125 179.5 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -117.91 169.31 9.74 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.664 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.18 156.46 87.99 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.347 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.62 -27.81 84.04 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.267 1.978 . . . . 10.0 112.048 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -94.75 -0.86 53.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.817 -0.628 . . . . 10.0 110.417 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 58.71 31.37 21.09 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.718 -0.673 . . . . 10.0 111.004 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -82.08 -36.41 27.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.895 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -137.8 175.22 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.359 0.599 . . . . 10.0 111.332 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.1 172.21 13.33 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.86 -1.064 . . . . 10.0 110.558 -178.091 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.08 -164.9 10.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.971 -0.633 . . . . 10.0 112.157 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -96.31 151.74 19.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.937 -0.743 . . . . 10.0 112.073 -179.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.26 -126.98 1.53 Allowed Glycine 0 C--N 1.332 0.349 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.21 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 tt -142.98 145.06 23.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-N 117.599 0.7 . . . . 10.0 111.453 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -107.7 139.96 41.48 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.886 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 36.7 mt -124.19 132.31 53.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.889 0.376 . . . . 10.0 110.275 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 m -76.56 164.55 25.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.934 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -60.82 -44.04 97.43 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.701 0.259 . . . . 10.0 111.701 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -60.43 -47.29 86.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.197 0.522 . . . . 10.0 110.708 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.573 ' HB3' HD13 ' B' ' 16' ' ' LEU . 38.6 mt-10 -64.03 -45.2 89.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.597 179.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.721 ' CE2' HD11 ' A' ' 66' ' ' LEU . 20.3 t80 -58.25 -44.45 88.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.329 -0.85 . . . . 10.0 111.005 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.54 -52.72 51.45 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.312 -0.47 . . . . 10.0 112.379 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.5 t -61.9 -42.85 96.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 120.969 0.414 . . . . 10.0 110.587 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.548 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.8 tp -57.42 -55.65 32.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.584 -0.735 . . . . 10.0 110.932 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.721 HD11 ' CE2' ' A' ' 62' ' ' PHE . 20.3 mt -63.25 -43.03 99.17 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.007 -0.277 . . . . 10.0 111.614 -179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.3 ttpp -51.56 -51.54 54.52 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.424 0.453 . . . . 10.0 111.189 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.549 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 32.8 mm-40 -71.89 -44.18 64.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.394 -179.257 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 73.2 mt -58.8 -45.31 90.19 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.26 94.54 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.6 -0.809 . . . . 10.0 111.092 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.25 -29.69 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 10.0 110.591 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 34.3 mmtt -68.67 -25.25 64.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.22 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.572 HD11 ' HB3' ' B' ' 66' ' ' LEU . 37.4 mt -89.55 -0.79 57.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.666 -179.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.138 -0.934 . . . . 10.0 111.019 -179.216 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.03 0.443 . . . . 10.0 110.553 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.98 164.78 11.69 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -62.57 -58.26 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.464 0.649 . . . . 10.0 109.449 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -134.15 112.92 11.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.056 -0.975 . . . . 10.0 109.36 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 32.2 tp -82.33 133.95 35.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.6 tppt? -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.948 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -155.48 163.84 39.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.254 -0.43 . . . . 10.0 109.842 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.488 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.5 tp10 -145.97 126.49 14.14 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.597 -0.52 . . . . 10.0 109.597 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.484 ' HA ' HG12 ' B' ' 30' ' ' VAL . 39.5 mt -79.6 108.78 13.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.453 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -74.86 -45.1 44.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.874 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -170.15 134.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.655 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -76.89 144.56 38.85 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.616 179.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 76.2 mt -113.76 -72.21 0.71 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.449 -0.5 . . . . 10.0 112.08 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.447 HD12 ' CB ' ' A' ' 68' ' ' GLU . 13.2 mm -131.52 139.15 51.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.038 0.447 . . . . 10.0 111.996 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 p -122.83 123.89 69.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.665 -1.235 . . . . 10.0 107.665 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' LEU . . . . . 0.573 HD13 ' HB3' ' A' ' 61' ' ' GLU . 41.4 mt -93.38 -82.06 0.35 Allowed 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.045 -0.662 . . . . 10.0 112.023 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.6 m -174.19 -167.9 0.36 Allowed 'General case' 0 C--O 1.236 0.388 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.517 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 2.0 mp0 -111.87 134.99 53.07 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 10.0 109.916 178.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -72.73 -175.87 1.82 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.51 66.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.518 0.675 . . . . 10.0 110.211 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -89.7 -3.49 58.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.265 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.94 3.37 79.95 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.234 -0.746 . . . . 10.0 111.234 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.517 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -61.59 108.58 1.0 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.686 0.279 . . . . 10.0 111.483 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' B' ' 43' ' ' THR . 5.5 tpp85 -86.49 99.97 12.04 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.351 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' B' ' 43' ' ' THR . 86.8 mttt -83.18 118.6 23.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.933 0.397 . . . . 10.0 110.761 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -133.91 144.48 48.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.748 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.692 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.9 tp -114.87 107.82 15.93 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -133.76 160.22 38.25 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.984 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' B' ' 29' ' ' ARG . 20.8 ttm180 -95.52 114.23 25.97 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.484 HG12 ' HA ' ' B' ' 9' ' ' ILE . 17.8 m -127.1 158.03 38.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.985 0.421 . . . . 10.0 110.587 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.2 p -97.35 126.05 42.34 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.032 0.444 . . . . 10.0 110.494 179.195 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -64.21 108.71 1.64 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.492 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.5 m-80 60.34 26.43 15.95 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.836 0.71 . . . . 10.0 110.267 -178.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 67.25 22.29 9.69 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.046 -0.979 . . . . 10.0 110.922 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.41 -75.35 0.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.062 -0.399 . . . . 10.0 111.429 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -98.86 118.78 62.38 Favored Pre-proline 0 C--N 1.33 -0.264 0 N-CA-C 111.71 0.263 . . . . 10.0 111.71 -178.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 61.7 Cg_endo -77.89 120.77 5.18 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.781 2.32 . . . . 10.0 111.514 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.43 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 21.1 ttmm -143.1 169.98 16.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' TYR . . . . . 0.43 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 22.4 m-85 -93.55 128.95 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.716 0.293 . . . . 10.0 110.556 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -141.43 132.39 26.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.692 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.5 tt -110.71 122.07 64.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.257 0.551 . . . . 10.0 110.013 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.442 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.7 mtt85 -144.18 -179.74 6.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.209 -177.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.581 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.17 143.41 50.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.138 179.853 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -117.82 171.37 8.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.022 -0.536 . . . . 10.0 109.664 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -68.44 157.04 89.12 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -22.15 70.45 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.414 2.076 . . . . 10.0 111.859 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -100.72 0.07 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.13 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 58.34 30.05 19.02 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.075 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.1 -39.96 28.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.094 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -135.44 174.5 10.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 10.0 111.516 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -134.57 172.47 12.88 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.949 -1.023 . . . . 10.0 110.533 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.34 -161.95 9.01 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.127 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -99.44 147.08 25.65 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.989 -0.713 . . . . 10.0 112.142 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.431 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -141.98 -124.44 1.96 Allowed Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.144 -0.934 . . . . 10.0 110.777 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -145.82 146.46 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 117.556 0.678 . . . . 10.0 110.807 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.9 m -107.79 139.89 41.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.197 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.3 mt -124.25 132.29 53.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.234 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.23 166.78 22.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.179 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.26 -40.78 96.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.677 -0.238 . . . . 10.0 111.288 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.516 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.4 pt-20 -63.76 -44.74 92.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.421 . . . . 10.0 110.511 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.445 ' OE2' ' HD2' ' A' ' 25' ' ' LYS . 36.1 mt-10 -66.47 -46.85 74.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.608 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.451 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.5 t80 -58.23 -39.26 78.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.438 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.61 -49.72 75.47 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.203 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 60' ' ' GLU . 8.2 t -66.5 -43.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.044 0.449 . . . . 10.0 110.432 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.3 tp -56.27 -54.73 41.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.887 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.572 ' HB3' HD11 ' A' ' 73' ' ' LEU . 48.9 mt -61.19 -47.82 84.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.126 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -50.49 -53.59 28.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.689 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.682 ' HB3' HD12 ' A' ' 14' ' ' ILE . 27.8 mm-40 -69.5 -47.17 64.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.844 -178.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.501 ' HB3' HD22 ' A' ' 66' ' ' LEU . 70.6 mt -60.13 -41.2 92.18 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.752 0.279 . . . . 10.0 111.752 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.21 -36.27 92.65 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.603 -0.808 . . . . 10.0 111.267 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -74.05 -29.66 62.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.077 0.465 . . . . 10.0 110.775 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 38.6 mmtt -65.56 -26.45 67.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.611 HD11 ' CB ' ' A' ' 66' ' ' LEU . 27.0 mt -89.44 3.24 52.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.694 0.283 . . . . 10.0 111.558 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.254 1.29 0 CA-C-O 118.567 -0.73 . . . . 10.0 110.105 179.694 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.8 mtm . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 120.879 0.371 . . . . 10.0 110.539 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.12 160.29 14.39 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.416 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 13.0 t70 -62.19 -57.32 11.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 39.1 mmtm -138.29 94.29 2.85 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.7 137.8 58.02 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.6 tppt? -71.75 134.29 46.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.148 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -159.58 170.12 22.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.006 179.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.444 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.13 133.52 11.81 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.285 -0.416 . . . . 10.0 109.938 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 70.7 mt -80.74 110.48 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.107 0.479 . . . . 10.0 110.418 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.426 HG13 ' HB3' ' A' ' 37' ' ' PRO . 33.4 mm -82.8 -39.61 15.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.215 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -167.3 139.35 3.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.841 -179.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.15 137.08 32.93 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 53.1 mt -104.55 -76.01 0.61 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.488 -0.485 . . . . 10.0 110.828 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.796 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.6 mm -134.92 134.22 53.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.222 0.534 . . . . 10.0 111.848 -178.147 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.418 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -114.63 121.93 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 177.25 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' B' ' 61' ' ' GLU . 32.0 mt -89.38 -80.67 0.3 Allowed 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.496 -0.482 . . . . 10.0 111.837 -177.515 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.2 m -179.64 -168.57 0.12 Allowed 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.293 0.371 . . . . 10.0 110.058 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.1 mp0 -110.49 146.33 36.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.402 ' CG ' ' H ' ' A' ' 20' ' ' ALA . 11.9 t-20 -89.55 -168.82 2.27 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.132 -0.692 . . . . 10.0 109.132 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.402 ' H ' ' CG ' ' A' ' 19' ' ' ASN . . . -64.28 -26.42 68.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.481 0.658 . . . . 10.0 111.006 -178.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -85.94 -0.14 54.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.218 -0.901 . . . . 10.0 110.837 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.25 2.98 90.37 Favored Glycine 0 N--CA 1.444 -0.773 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -58.56 108.89 0.69 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 111.467 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.5 tpp85 -79.96 108.93 13.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.17 178.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.564 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 61.5 mttt -88.89 109.82 20.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.194 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.418 ' HG2' HG23 ' A' ' 15' ' ' VAL . 48.2 mt-10 -133.28 149.3 51.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.627 0.727 . . . . 10.0 112.412 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.853 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.4 tp -122.36 108.54 13.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.518 -1.219 . . . . 10.0 107.882 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -134.16 166.28 23.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.304 0.574 . . . . 10.0 111.961 -177.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 29' ' ' ARG . 6.3 ttm180 -98.71 114.33 26.8 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.6 m -128.71 156.83 41.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.761 0.315 . . . . 10.0 110.651 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.444 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.8 OUTLIER -93.51 123.91 37.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.252 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -64.4 108.82 1.73 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.784 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.404 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 60.74 30.3 19.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.932 -178.126 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t0 66.29 18.77 10.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.669 -1.151 . . . . 10.0 111.206 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.26 -93.1 0.28 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.599 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -84.94 126.59 67.61 Favored Pre-proline 0 C--O 1.233 0.22 0 CA-C-O 120.582 0.23 . . . . 10.0 111.593 -179.014 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.426 ' HB3' HG13 ' A' ' 10' ' ' ILE . 71.6 Cg_endo -81.0 120.42 3.76 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.042 2.495 . . . . 10.0 111.818 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -139.36 167.04 22.97 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -92.52 129.93 38.32 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.506 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t0 -139.88 132.94 29.53 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.892 -0.411 . . . . 10.0 109.892 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.853 ' HB ' HD13 ' A' ' 27' ' ' LEU . 13.7 tt -109.33 122.01 63.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.506 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.91 170.87 15.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.508 0.67 . . . . 10.0 112.103 -177.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.564 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.32 131.49 55.93 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 114.881 -1.054 . . . . 10.0 110.205 179.458 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -117.43 176.7 5.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.255 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.88 156.71 84.31 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -55.3 -37.5 94.47 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.729 2.286 . . . . 10.0 112.557 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -94.22 3.57 55.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.239 0.542 . . . . 10.0 110.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.8 m170 61.09 26.32 16.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.618 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.18 -35.06 77.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.728 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 50' ' ' LYS . 36.4 mmtm -141.76 174.42 10.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.533 . . . . 10.0 111.291 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.88 172.29 11.84 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.457 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.93 -175.28 14.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.813 -0.708 . . . . 10.0 112.461 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -91.85 139.03 31.06 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.427 -0.455 . . . . 10.0 111.901 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.4 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -138.77 -121.2 1.9 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.369 -0.832 . . . . 10.0 111.174 179.166 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.3 tt -150.67 143.73 17.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.335 0.568 . . . . 10.0 111.012 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -104.39 135.59 45.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.53 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.8 mt -113.9 121.99 45.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.58 176.92 9.26 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.8 -0.36 . . . . 10.0 110.448 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.78 -41.5 91.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.192 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.495 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 13.4 pt-20 -56.14 -47.88 77.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.336 0.589 . . . . 10.0 110.739 178.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.495 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 30.1 mt-10 -67.16 -60.18 2.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.329 -0.851 . . . . 10.0 111.663 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.621 ' CE2' HD11 ' A' ' 66' ' ' LEU . 5.1 t80 -48.29 -45.11 34.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.235 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.69 34.85 Favored Glycine 0 C--O 1.237 0.313 0 C-N-CA 121.389 -0.434 . . . . 10.0 113.264 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.9 t -69.58 -43.62 80.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.736 0.303 . . . . 10.0 111.419 -179.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.96 -52.45 65.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.431 -178.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.628 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.3 mt -62.93 -46.15 89.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 120.788 -0.365 . . . . 10.0 111.465 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -52.32 -50.42 62.29 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.598 0.562 . . . . 10.0 110.906 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.658 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 34.6 mm-40 -70.55 -50.15 40.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.813 -0.631 . . . . 10.0 111.947 -179.045 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 mt -55.89 -47.49 77.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.574 0.226 . . . . 10.0 111.58 -179.283 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.93 -31.22 80.21 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.601 -0.809 . . . . 10.0 111.592 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -74.37 -32.85 62.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.64 0.257 . . . . 10.0 111.116 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.658 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 33.3 mmtt -70.22 -24.24 63.06 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.71 0.29 . . . . 10.0 110.971 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' B' ' 66' ' ' LEU . 22.5 mt -85.05 -6.46 59.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.113 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.442 -0.79 . . . . 10.0 110.634 -179.542 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.871 0.367 . . . . 10.0 110.23 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.82 163.82 14.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -68.93 -55.12 11.98 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -137.94 93.24 2.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.934 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -63.91 139.82 58.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.376 . . . . 10.0 110.656 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -74.33 134.88 42.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.852 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -161.31 171.31 18.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.491 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -156.48 131.59 9.18 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -78.53 108.61 12.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.239 0.543 . . . . 10.0 110.534 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' B' ' 37' ' ' PRO . 24.5 mm -80.8 -40.52 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.936 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -166.79 138.91 3.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.621 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -84.22 139.63 32.23 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.4 mt -108.05 -73.42 0.69 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.433 -0.507 . . . . 10.0 111.274 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.589 HD12 ' HB3' ' A' ' 68' ' ' GLU . 14.7 mm -136.13 132.62 50.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.815 0.34 . . . . 10.0 111.761 -178.16 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.441 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -114.05 122.29 67.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 107.578 -1.268 . . . . 10.0 107.578 176.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.7 mt -88.31 -81.13 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.429 -0.509 . . . . 10.0 111.83 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 179.06 -169.21 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.543 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 11.5 mp0 -109.56 145.68 35.94 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.072 -0.344 . . . . 10.0 110.072 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -88.09 -168.28 2.16 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.62 -22.27 66.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.192 0.52 . . . . 10.0 111.155 -179.095 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -91.02 1.8 56.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 0.95 90.08 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.111 -0.796 . . . . 10.0 111.111 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -56.53 109.39 0.61 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.576 -0.312 . . . . 10.0 111.697 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.3 tpp85 -80.03 110.63 15.6 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.525 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 61.0 mttt -90.04 110.86 21.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.394 -179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.441 ' HG2' HG23 ' B' ' 15' ' ' VAL . 48.1 mt-10 -134.74 150.37 50.56 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.627 0.727 . . . . 10.0 112.333 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.81 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.3 tp -123.97 108.9 12.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.556 -1.202 . . . . 10.0 108.006 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -134.25 166.59 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.18 0.514 . . . . 10.0 111.828 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' B' ' 29' ' ' ARG . 7.2 ttm180 -98.05 113.75 25.72 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.32 -0.992 . . . . 10.0 108.32 178.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.5 m -128.74 155.46 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.887 0.375 . . . . 10.0 110.735 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -93.05 124.89 37.34 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.922 0.391 . . . . 10.0 110.584 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -64.44 109.32 1.9 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.689 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 60.3 29.9 19.39 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.539 0.685 . . . . 10.0 109.779 -178.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 41.7 t0 65.37 22.18 11.98 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.269 -1.332 . . . . 10.0 111.154 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.41 -89.18 0.38 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.488 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -88.79 125.9 61.32 Favored Pre-proline 0 C--O 1.235 0.302 0 CA-C-O 120.705 0.288 . . . . 10.0 111.426 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.423 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.4 Cg_endo -79.07 121.81 5.05 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.804 2.336 . . . . 10.0 111.582 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -140.49 164.31 30.47 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -90.75 127.68 36.41 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.514 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t0 -138.27 134.0 33.81 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.81 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.9 tt -110.21 120.95 62.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.514 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -143.9 169.84 17.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.543 0.687 . . . . 10.0 112.286 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.525 ' CG2' ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -113.21 131.13 56.01 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 114.838 -1.074 . . . . 10.0 110.356 179.467 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m0 -117.5 175.41 5.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.234 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.84 158.04 86.52 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -58.12 -33.02 96.94 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.529 2.152 . . . . 10.0 112.32 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -94.87 1.04 55.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.473 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 24.8 m170 62.28 24.27 14.43 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.284 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -66.99 -38.28 85.75 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.856 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -139.48 174.27 10.69 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.209 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.22 172.76 11.46 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.648 -178.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.9 -173.51 13.28 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.518 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 6.8 mtpp -93.64 136.31 34.05 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.243 -0.563 . . . . 10.0 111.863 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.45 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -134.96 -123.01 2.29 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 110.65 -0.98 . . . . 10.0 110.65 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.3 tt -150.43 143.05 17.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.39 0.595 . . . . 10.0 110.798 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.96 134.58 46.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.731 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 46.7 mt -112.69 120.24 40.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.96 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.06 174.97 11.06 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.935 -0.306 . . . . 10.0 110.414 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -58.37 -42.6 87.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.54 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.477 ' O ' HG23 ' B' ' 64' ' ' VAL . 12.1 pt-20 -55.91 -43.83 77.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.387 0.613 . . . . 10.0 110.678 178.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.543 ' HA ' HD13 ' A' ' 16' ' ' LEU . 31.3 mt-10 -70.94 -58.58 3.44 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.365 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 0.8 OUTLIER -52.74 -40.62 63.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.594 -178.425 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.27 -56.33 24.25 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.905 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.518 ' HB ' HD22 ' A' ' 16' ' ' LEU . 13.5 t -68.24 -44.79 83.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.844 0.354 . . . . 10.0 111.366 -179.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.1 tp -57.12 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.531 -178.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.651 ' HB3' HD11 ' A' ' 73' ' ' LEU . 23.4 mt -60.1 -52.74 64.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.6 0.238 . . . . 10.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttm -49.05 -51.71 29.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.642 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.796 ' HB3' HD12 ' A' ' 14' ' ' ILE . 55.2 mm-40 -69.56 -51.31 36.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.124 -0.489 . . . . 10.0 112.092 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.628 ' HB3' HD22 ' A' ' 66' ' ' LEU . 62.4 mt -57.05 -46.16 82.66 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.701 0.26 . . . . 10.0 111.701 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.35 93.28 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.282 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 71' ' ' ASN . . . . . 0.423 ' HA ' ' HG3' ' B' ' 74' ' ' GLU . 2.0 t-20 -72.06 -30.83 65.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.58 -0.31 . . . . 10.0 111.688 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.677 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 13.9 mmtt -69.36 -25.48 64.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.541 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.579 HD11 ' HB3' ' A' ' 66' ' ' LEU . 19.1 mt -88.62 -2.76 58.76 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.384 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 74' ' ' GLU . . . . . 0.423 ' HG3' ' HA ' ' B' ' 71' ' ' ASN . 36.6 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.955 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.789 0.328 . . . . 10.0 110.426 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.47 163.53 13.37 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -72.28 -50.86 23.9 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.611 -0.514 . . . . 10.0 109.611 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -134.77 94.57 3.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.887 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.3 tp -68.46 140.53 55.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.463 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.48 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -74.53 131.47 41.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.616 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -158.03 171.83 19.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.393 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.418 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.27 135.19 12.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.346 -0.612 . . . . 10.0 109.346 178.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.425 ' HA ' HG12 ' A' ' 30' ' ' VAL . 65.1 mt -83.38 117.47 29.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 mm -84.95 -49.25 15.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.293 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -165.77 134.17 3.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.263 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -79.47 137.83 37.36 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.276 -0.638 . . . . 10.0 109.276 178.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.572 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 87.9 mt -105.75 -72.1 0.72 Allowed 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.793 -0.363 . . . . 10.0 111.467 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.606 HD12 ' HB3' ' B' ' 68' ' ' GLU . 27.2 mm -131.75 140.86 47.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.094 0.474 . . . . 10.0 111.924 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.76 120.8 58.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 108.11 -1.07 . . . . 10.0 108.11 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.608 HD22 ' HB ' ' B' ' 64' ' ' VAL . 25.6 mt -91.02 -80.77 0.33 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.159 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 179.36 -170.38 0.13 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -106.67 140.08 40.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.817 0.341 . . . . 10.0 110.239 179.004 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -77.48 -174.63 3.43 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.01 -24.47 67.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.536 0.684 . . . . 10.0 110.837 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -90.21 3.02 54.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.155 -0.93 . . . . 10.0 110.692 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.06 6.01 87.01 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.207 -0.757 . . . . 10.0 111.207 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.433 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.6 m0 -62.1 100.33 0.16 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.839 0.352 . . . . 10.0 111.346 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 43' ' ' THR . 13.3 tpp85 -81.12 99.42 8.5 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.371 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' A' ' 43' ' ' THR . 89.9 mttt -83.5 112.23 19.78 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.864 0.364 . . . . 10.0 110.52 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -131.55 149.31 52.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.842 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.679 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.3 tp -118.3 108.16 14.76 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.099 -1.075 . . . . 10.0 108.099 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -133.38 160.7 36.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 10.0 111.152 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 29' ' ' ARG . 32.6 ttm180 -96.79 114.97 26.65 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' A' ' 9' ' ' ILE . 17.2 m -127.92 160.47 37.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.801 0.334 . . . . 10.0 110.569 -179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.6 p -96.58 122.53 39.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.926 0.393 . . . . 10.0 110.453 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -64.2 109.97 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.014 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.2 m-80 59.12 31.0 20.91 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.781 0.676 . . . . 10.0 110.158 -178.465 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t70 61.61 30.06 18.47 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.763 -1.108 . . . . 10.0 110.959 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.75 -77.83 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.058 -0.402 . . . . 10.0 111.705 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -97.12 120.47 61.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 120.631 0.253 . . . . 10.0 111.589 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.502 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 69.0 Cg_endo -78.62 120.85 4.9 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.484 2.123 . . . . 10.0 111.325 178.679 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -141.25 168.5 19.62 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.424 ' HD1' HD11 ' A' ' 13' ' ' LEU . 2.8 m-85 -93.26 130.47 38.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.44 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -141.54 130.02 22.56 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.679 ' HB ' HD13 ' A' ' 27' ' ' LEU . 6.4 tt -106.32 121.31 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.345 0.593 . . . . 10.0 109.953 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.44 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.65 177.6 8.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.19 -177.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.581 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -120.77 142.22 49.77 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.497 179.197 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -117.01 176.63 5.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.29 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.431 ' HG ' ' H ' ' A' ' 50' ' ' LYS . 2.3 p -79.39 158.38 74.04 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -58.75 -30.86 93.75 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.53 2.153 . . . . 10.0 112.162 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -94.27 -5.35 46.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.834 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 60.83 34.59 19.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.6 -178.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -88.26 -32.51 18.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.472 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.431 ' H ' ' HG ' ' A' ' 45' ' ' SER . 39.0 mmtm -141.84 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.119 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.443 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -145.42 172.73 12.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.278 -177.701 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.63 -154.82 7.49 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.092 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.4 ' HA ' ' NH2' ' A' ' 42' ' ' ARG . 36.5 mttp -101.58 157.3 16.92 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 122.169 -0.607 . . . . 10.0 112.066 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.81 -122.36 0.99 Allowed Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.775 -0.93 . . . . 10.0 110.775 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -149.38 141.42 17.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 117.759 0.78 . . . . 10.0 111.367 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.51 144.67 31.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -129.79 130.66 45.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.113 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -84.97 175.21 9.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.774 -0.194 . . . . 10.0 110.905 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -53.69 -58.68 6.32 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.49 0.552 . . . . 10.0 112.49 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -57.69 -49.01 77.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.757 0.313 . . . . 10.0 111.829 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -58.99 -49.0 79.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.204 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.666 ' CE2' HD11 ' A' ' 66' ' ' LEU . 25.2 t80 -62.62 -44.07 97.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.486 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.53 -54.56 36.21 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.101 -0.499 . . . . 10.0 112.917 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.448 ' HB ' HD22 ' B' ' 16' ' ' LEU . 53.4 t -60.2 -42.14 89.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.295 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.486 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -57.59 -53.06 62.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.462 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.681 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.2 mt -62.18 -46.14 90.26 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 -179.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -51.27 -51.35 54.99 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 123.635 0.584 . . . . 10.0 111.522 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.605 ' CB ' HD12 ' B' ' 14' ' ' ILE . 49.9 mm-40 -70.24 -46.69 63.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.339 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 69.0 mt -58.53 -44.15 89.47 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 111.682 0.253 . . . . 10.0 111.682 -179.177 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.57 -38.87 97.09 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.824 -0.703 . . . . 10.0 111.596 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -71.37 -29.05 64.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.813 0.34 . . . . 10.0 110.755 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 54.5 mmtt -66.55 -25.11 66.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.362 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' B' ' 66' ' ' LEU . 24.2 mt -85.68 -11.93 52.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.448 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.706 -0.664 . . . . 10.0 110.635 179.947 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.859 0.361 . . . . 10.0 110.446 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.01 160.57 16.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.416 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 14.8 t70 -72.22 -48.37 43.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.416 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 32.8 mmtm -135.05 94.46 3.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.66 -0.7 . . . . 10.0 109.546 179.006 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 26.9 tp -68.84 140.32 55.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.407 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -74.05 129.72 38.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.597 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -158.01 170.04 23.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.064 -0.517 . . . . 10.0 110.263 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.441 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 6.2 tp10 -152.63 133.05 13.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.506 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.578 ' HA ' HG12 ' B' ' 30' ' ' VAL . 63.7 mt -82.07 117.81 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.093 0.473 . . . . 10.0 110.124 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 39.5 mm -85.24 -50.82 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.377 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 -162.94 133.38 4.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.43 142.64 37.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.1 mt -112.43 -67.95 0.96 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.64 -0.424 . . . . 10.0 111.677 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.605 HD12 ' CB ' ' A' ' 68' ' ' GLU . 21.2 mm -133.03 141.38 44.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.826 0.346 . . . . 10.0 111.787 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -128.31 116.74 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 177.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' LEU . . . . . 0.448 HD22 ' HB ' ' A' ' 64' ' ' VAL . 34.6 mt -86.14 -81.07 0.22 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.616 -177.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 178.99 -168.48 0.09 Allowed 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.473 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 0.8 OUTLIER -108.39 141.37 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.154 -0.313 . . . . 10.0 110.154 178.841 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -78.82 -172.76 3.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.25 66.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 10.0 110.879 -179.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -93.24 2.74 56.5 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.376 -0.829 . . . . 10.0 110.198 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.43 5.5 84.86 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.664 -0.779 . . . . 10.0 111.436 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.473 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -61.33 101.61 0.18 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.867 0.365 . . . . 10.0 111.641 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' B' ' 43' ' ' THR . 14.1 tpp85 -81.63 99.72 9.03 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.408 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.603 ' HG2' HG22 ' B' ' 43' ' ' THR . 90.5 mttt -83.46 113.6 20.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.974 0.416 . . . . 10.0 110.907 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -132.98 148.95 52.27 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.639 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.718 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.8 tp -119.3 107.62 13.62 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 178.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -133.18 161.33 34.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.968 0.413 . . . . 10.0 111.211 -177.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -97.7 114.68 26.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.578 HG12 ' HA ' ' B' ' 9' ' ' ILE . 23.0 m -127.28 159.92 36.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.518 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.2 p -95.01 122.85 38.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 10.0 110.775 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -64.27 110.45 2.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.783 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 65.1 m-80 59.43 29.26 18.8 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.23 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 64.11 24.81 13.58 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.834 -1.075 . . . . 10.0 110.903 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.9 -82.98 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.764 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -92.42 120.41 67.53 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 10.0 111.63 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.2 Cg_endo -76.84 124.05 7.22 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.617 2.212 . . . . 10.0 111.124 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.405 ' HD2' ' CG2' ' B' ' 56' ' ' THR . 22.0 ttmm -144.28 165.94 26.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -92.0 129.52 37.94 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -140.26 130.01 24.45 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.718 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.1 tt -105.53 121.59 57.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 10.0 109.951 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.442 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.9 mtt85 -145.04 176.85 9.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.398 -177.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.603 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -120.56 142.2 49.57 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.645 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -116.92 177.34 4.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.028 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -80.97 159.48 68.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.49 -28.79 88.37 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.385 2.056 . . . . 10.0 112.073 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.35 -5.75 42.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.641 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 62.53 28.35 16.68 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.984 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.55 -36.42 29.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.713 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -138.51 172.56 12.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.452 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 51' ' ' MET . . . . . 0.432 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -146.78 172.46 13.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.418 -177.761 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.82 -154.67 7.61 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.676 -0.773 . . . . 10.0 112.161 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.51 156.09 17.48 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 122.2 -0.588 . . . . 10.0 111.953 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.1 -121.17 1.11 Allowed Glycine 0 N--CA 1.452 -0.297 0 N-CA-C 110.761 -0.936 . . . . 10.0 110.761 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.2 tt -151.43 141.38 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 117.74 0.77 . . . . 10.0 111.166 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.405 ' CG2' ' HD2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -103.96 145.67 29.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.591 -179.575 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 32.6 mt -128.95 128.83 44.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.272 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -83.57 173.36 11.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.696 -0.229 . . . . 10.0 110.867 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -51.86 -56.6 13.04 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.567 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.5 pt-20 -60.53 -47.09 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.808 0.299 . . . . 10.0 111.808 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.32 -47.44 85.93 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.38 . . . . 10.0 110.974 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -66.14 -40.12 90.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.807 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.07 -53.72 43.25 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.093 -0.503 . . . . 10.0 112.857 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.608 ' HB ' HD22 ' A' ' 16' ' ' LEU . 14.1 t -62.31 -41.7 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 120.979 0.419 . . . . 10.0 110.119 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.2 tp -58.25 -52.44 65.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.453 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.463 ' HB3' HD11 ' A' ' 73' ' ' LEU . 49.6 mt -60.36 -48.71 80.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.331 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -50.34 -53.79 26.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 10.0 111.918 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.606 ' HB3' HD12 ' A' ' 14' ' ' ILE . 65.5 mm-40 -69.79 -47.32 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.015 -0.538 . . . . 10.0 111.933 -178.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.681 ' HB3' HD22 ' A' ' 66' ' ' LEU . 59.9 mt -59.91 -44.29 94.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.904 0.335 . . . . 10.0 111.904 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.16 -36.48 93.02 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.466 -0.873 . . . . 10.0 111.289 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.46 -28.39 61.02 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.699 0.285 . . . . 10.0 111.153 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.8 mmtt -65.45 -24.46 67.18 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 111.968 0.359 . . . . 10.0 111.968 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.647 HD11 ' HB3' ' A' ' 66' ' ' LEU . 23.2 mt -88.85 -4.28 58.52 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.722 -0.391 . . . . 10.0 111.53 -179.496 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.644 -0.694 . . . . 10.0 110.116 179.35 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mmt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.976 0.417 . . . . 10.0 110.265 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.33 172.17 6.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.273 -0.421 . . . . 10.0 109.917 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.581 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 32.2 t70 -76.86 -57.0 4.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.011 0.434 . . . . 10.0 110.001 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.581 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 38.5 mmtm -135.42 95.38 3.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.873 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.52 141.76 58.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.801 0.334 . . . . 10.0 110.532 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -77.21 131.7 38.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.221 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -155.43 174.25 15.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.501 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.552 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.52 127.07 7.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.908 179.182 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.427 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.6 mt -81.54 111.81 18.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.141 0.496 . . . . 10.0 109.727 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.447 HG13 ' HB3' ' A' ' 37' ' ' PRO . 29.8 mm -80.28 -50.89 16.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.506 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -159.86 130.31 5.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.418 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -74.44 142.61 44.92 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 73.4 mt -110.64 -75.18 0.63 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.294 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.713 HD12 ' HB3' ' B' ' 68' ' ' GLU . 27.8 mm -132.45 140.96 46.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.227 0.537 . . . . 10.0 112.146 -177.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.86 123.58 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 107.962 -1.125 . . . . 10.0 107.962 177.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.598 HD22 ' HB ' ' B' ' 64' ' ' VAL . 31.0 mt -94.65 -81.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.531 -0.468 . . . . 10.0 112.208 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 m -176.34 -168.38 0.25 Allowed 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.427 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -106.6 147.56 29.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.754 179.235 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -83.61 -172.78 4.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.19 -26.22 68.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.819 0.819 . . . . 10.0 109.911 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -88.67 -0.6 57.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.739 -1.118 . . . . 10.0 111.025 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.76 5.1 81.86 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.619 -0.8 . . . . 10.0 111.5 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.427 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -62.41 106.76 0.8 Allowed 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.866 0.365 . . . . 10.0 111.187 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.5 tpp85 -82.94 100.06 10.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.551 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.683 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.3 mttt -81.39 116.57 21.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.881 0.372 . . . . 10.0 110.56 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -132.97 152.24 51.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.084 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.656 HD13 ' HB ' ' A' ' 41' ' ' ILE . 46.3 tp -121.28 108.16 13.39 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 107.79 -1.189 . . . . 10.0 107.79 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -132.17 159.57 38.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 10.0 110.794 -178.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -96.9 113.65 25.2 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.284 -1.006 . . . . 10.0 108.284 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.427 HG12 ' HA ' ' A' ' 9' ' ' ILE . 11.4 m -127.37 158.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.776 0.322 . . . . 10.0 110.894 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.552 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -95.83 125.03 40.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.633 179.103 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.9 m0 -64.23 107.61 1.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.674 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.2 m-80 61.21 31.12 19.54 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.513 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.9 t0 66.33 17.08 10.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.056 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.82 -85.08 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.087 -0.383 . . . . 10.0 111.818 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -96.18 122.61 57.54 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 111.922 0.342 . . . . 10.0 111.922 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.504 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.7 Cg_endo -77.27 125.3 7.7 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.067 2.511 . . . . 10.0 111.676 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -143.35 167.98 20.88 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -93.96 126.38 39.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.209 -0.293 . . . . 10.0 110.209 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.45 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -138.27 133.2 32.81 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.656 ' HB ' HD13 ' A' ' 27' ' ' LEU . 14.5 tt -108.2 121.25 60.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.353 0.597 . . . . 10.0 109.956 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.45 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.44 -179.84 6.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.234 -177.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.683 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -123.73 145.38 49.05 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.688 179.267 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.5 m95 -117.48 168.44 10.38 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.96 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.1 m -66.79 157.74 82.68 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 178.387 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -51.7 -31.7 42.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.093 2.529 . . . . 10.0 113.28 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -107.5 11.92 28.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.226 0.536 . . . . 10.0 110.459 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 54.3 m80 59.03 25.36 13.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.949 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -73.84 -39.67 63.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.734 0.302 . . . . 10.0 111.084 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -133.51 175.42 9.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.316 0.579 . . . . 10.0 111.087 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -140.43 172.78 12.25 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.497 -178.31 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.44 -161.55 8.85 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.583 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -97.77 146.0 25.82 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 122.279 -0.542 . . . . 10.0 112.331 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.443 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -143.15 -126.99 2.08 Favored Glycine 0 CA--C 1.519 0.299 0 N-CA-C 111.097 -0.801 . . . . 10.0 111.097 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 tt -146.77 142.93 20.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 117.888 0.844 . . . . 10.0 111.519 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.0 144.66 30.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.785 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.1 mt -123.77 131.38 53.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.573 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -77.92 171.67 14.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.943 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -64.54 -46.54 82.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.506 0.193 . . . . 10.0 111.248 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.17 -43.8 95.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.231 0.539 . . . . 10.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.413 ' HB3' HD13 ' B' ' 16' ' ' LEU . 74.0 mt-10 -65.28 -52.66 52.8 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.113 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 66' ' ' LEU . 21.1 t80 -56.25 -43.72 78.98 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.343 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.68 -54.11 39.75 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.14 -0.552 . . . . 10.0 112.729 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 89.4 t -62.22 -42.47 95.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.768 0.318 . . . . 10.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.461 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 14.9 tp -58.53 -52.58 65.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.402 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.704 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.4 mt -61.87 -46.05 91.13 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.483 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -51.54 -52.82 43.93 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 123.456 0.473 . . . . 10.0 111.194 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.538 ' CB ' HD12 ' B' ' 14' ' ' ILE . 70.6 mm-40 -68.68 -46.75 68.23 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.711 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 79.9 mt -60.14 -43.67 95.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.683 0.277 . . . . 10.0 111.411 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.61 -33.99 88.73 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.72 -0.753 . . . . 10.0 111.346 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -73.98 -28.37 61.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.882 0.373 . . . . 10.0 110.786 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.64 -27.5 66.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.967 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' B' ' 66' ' ' LEU . 42.0 mt -90.0 -5.25 56.85 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.735 0.272 . . . . 10.0 111.735 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.656 -0.687 . . . . 10.0 110.665 -179.705 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.931 0.396 . . . . 10.0 109.976 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.53 168.18 9.43 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.448 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 36.1 t70 -76.49 -53.32 8.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.055 0.455 . . . . 10.0 110.078 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.448 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 38.2 mmtm -136.29 94.54 3.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.685 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.6 tp -65.4 139.26 58.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.856 0.36 . . . . 10.0 110.602 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.474 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.2 tppt? -75.58 130.69 39.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.57 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -153.94 174.3 14.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.196 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.524 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.8 tp10 -155.11 122.37 5.56 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.806 179.097 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.498 ' HA ' HG12 ' B' ' 30' ' ' VAL . 44.7 mt -77.65 109.83 12.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' B' ' 37' ' ' PRO . 28.6 mm -79.01 -51.83 16.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.664 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -158.87 127.97 5.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.265 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -72.26 145.06 48.16 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 53.1 mt -113.29 -72.12 0.72 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.488 -179.176 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.538 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.9 mm -133.17 140.63 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 10.0 112.052 -177.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' B' ' 26' ' ' GLU . 4.6 p -123.48 123.77 68.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 107.969 -1.123 . . . . 10.0 107.969 177.223 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 16' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 61' ' ' GLU . 30.5 mt -94.92 -81.19 0.4 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.473 -0.491 . . . . 10.0 112.012 -177.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.46 -168.42 0.15 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 -179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -106.87 147.57 29.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 10.0 110.271 179.311 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -83.69 -168.0 1.94 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.141 -0.482 . . . . 10.0 109.75 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.1 -23.45 64.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.282 0.563 . . . . 10.0 110.356 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -91.78 1.03 57.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.419 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.82 4.66 82.19 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.51 -0.852 . . . . 10.0 111.636 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -61.94 106.16 0.67 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.742 0.306 . . . . 10.0 110.973 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' B' ' 43' ' ' THR . 7.9 tpp85 -83.02 100.43 10.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.809 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.713 ' HG2' HG22 ' B' ' 43' ' ' THR . 93.3 mttt -81.03 116.97 21.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 10.0 110.891 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.443 ' HG2' HG23 ' B' ' 15' ' ' VAL . 66.9 mt-10 -132.57 150.39 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.937 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.632 HD13 ' HB ' ' B' ' 41' ' ' ILE . 41.2 tp -120.14 107.94 13.63 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.95 -1.13 . . . . 10.0 107.95 178.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -133.27 158.0 44.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.939 0.4 . . . . 10.0 111.159 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -94.93 114.0 25.79 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.414 -0.958 . . . . 10.0 108.414 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.498 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.2 m -128.16 156.15 40.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.362 . . . . 10.0 110.883 -178.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.524 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.7 OUTLIER -95.11 125.58 39.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.033 0.444 . . . . 10.0 110.626 179.175 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 10.5 m0 -64.24 110.11 2.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.956 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.474 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.7 m-80 60.6 28.71 18.41 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.667 0.604 . . . . 10.0 110.356 -178.566 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 40.4 t0 62.66 32.22 16.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.037 -0.983 . . . . 10.0 110.214 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.62 -82.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.025 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -98.16 122.38 54.35 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-O 120.646 0.26 . . . . 10.0 111.515 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.505 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 70.3 Cg_endo -77.12 121.78 5.92 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.809 2.339 . . . . 10.0 111.654 178.757 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.407 ' HD2' ' CG2' ' B' ' 56' ' ' THR . 19.7 ttmm -139.75 167.5 21.96 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -95.04 126.83 40.65 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.467 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -138.15 132.82 32.52 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.611 -0.515 . . . . 10.0 109.611 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.632 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.9 tt -106.44 121.76 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.183 0.516 . . . . 10.0 109.73 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.467 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -144.87 178.48 7.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.268 0.556 . . . . 10.0 111.599 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.713 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -121.86 145.0 48.51 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.573 -0.739 . . . . 10.0 109.743 179.453 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -117.73 167.09 11.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.673 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 16.6 m -66.35 157.98 79.69 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.504 -0.554 . . . . 10.0 109.504 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -51.48 -33.24 46.48 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.975 2.45 . . . . 10.0 112.908 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -105.1 11.29 33.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.102 0.477 . . . . 10.0 110.91 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.2 m80 57.76 27.66 14.75 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.38 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.23 -39.85 59.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.825 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -134.68 175.17 9.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 10.0 111.132 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 51' ' ' MET . . . . . 0.423 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -141.19 172.63 12.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.257 -0.883 . . . . 10.0 110.363 -178.111 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.63 -159.97 8.25 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.566 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -97.41 146.47 25.16 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.184 -0.598 . . . . 10.0 112.241 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.426 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -142.4 -129.02 2.34 Favored Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -147.48 140.9 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 117.666 0.733 . . . . 10.0 111.22 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.407 ' CG2' ' HD2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -100.83 147.92 25.54 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.16 -179.796 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 87.6 mt -126.52 132.94 51.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.383 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -79.92 169.52 17.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.27 -47.95 83.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 10.0 111.145 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.645 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.5 pt-20 -58.57 -44.31 89.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.608 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.463 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 65.6 mt-10 -66.48 -52.73 43.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.023 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.49 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.1 t80 -57.16 -41.56 79.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.858 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.75 -53.46 45.79 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.27 -0.491 . . . . 10.0 112.84 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.645 HG23 ' O ' ' B' ' 60' ' ' GLU . 15.6 t -62.97 -43.51 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.877 0.37 . . . . 10.0 110.503 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.1 tp -58.33 -51.98 67.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.358 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.573 ' HB3' HD11 ' A' ' 73' ' ' LEU . 62.1 mt -60.1 -49.61 76.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.812 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -50.74 -54.62 21.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.661 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.713 ' HB3' HD12 ' A' ' 14' ' ' ILE . 39.6 mm-40 -67.42 -47.57 69.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.053 -0.521 . . . . 10.0 112.027 -178.426 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.643 ' HB3' HD22 ' A' ' 66' ' ' LEU . 72.5 mt -61.75 -42.12 98.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.5 0.19 . . . . 10.0 111.455 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.73 -37.37 94.71 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -72.02 -28.81 63.62 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.023 0.44 . . . . 10.0 110.911 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.5 mmtt -64.44 -32.27 73.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.065 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.539 HD11 ' CB ' ' A' ' 66' ' ' LEU . 24.9 mt -90.66 6.06 45.49 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.794 -0.622 . . . . 10.0 109.788 179.209 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 mmt . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 120.889 0.376 . . . . 10.0 110.175 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 168.29 10.45 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.115 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.96 -58.22 3.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -135.95 105.19 5.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.0 tp -78.26 143.28 37.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 10.0 110.423 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -78.63 139.41 38.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.968 0.413 . . . . 10.0 111.268 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 p90 -162.84 175.92 10.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.608 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.44 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.9 tp10 -160.13 131.14 5.73 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.019 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.8 mt -80.38 112.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.785 0.326 . . . . 10.0 110.208 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.2 mm -85.48 -39.47 13.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.657 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -165.8 127.25 1.91 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.571 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.55 142.63 37.2 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 178.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.465 ' O ' HD13 ' A' ' 14' ' ' ILE . 72.2 mt -111.43 -74.47 0.64 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.559 -0.457 . . . . 10.0 111.627 -178.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.668 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.1 mm -129.41 144.57 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.143 0.497 . . . . 10.0 111.855 -177.61 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.401 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.6 p -128.56 126.52 65.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.653 HD13 ' HA ' ' B' ' 61' ' ' GLU . 36.0 mt -95.33 -80.57 0.41 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.704 -0.398 . . . . 10.0 111.249 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 m 175.82 -173.93 0.09 Allowed 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.378 0.671 . . . . 10.0 109.487 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.492 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -99.58 151.86 20.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.293 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -94.18 -173.33 3.06 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.07 -26.4 67.61 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.639 0.733 . . . . 10.0 110.811 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -89.17 3.09 53.09 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.022 -0.99 . . . . 10.0 110.719 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.36 -1.54 88.55 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.817 -0.706 . . . . 10.0 111.466 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.499 ' HB3' ' CG2' ' A' ' 43' ' ' THR . 40.2 m0 -56.13 107.05 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.987 0.366 . . . . 10.0 111.987 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 tpp85 -80.18 108.74 14.03 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.537 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 78.9 mttt -85.46 112.0 20.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.292 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.401 ' HG2' HG23 ' A' ' 15' ' ' VAL . 50.3 mt-10 -138.59 155.44 48.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.667 0.746 . . . . 10.0 112.122 -179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.801 HD13 ' HB ' ' A' ' 41' ' ' ILE . 36.4 tp -127.7 110.4 12.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.668 -1.151 . . . . 10.0 108.393 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.04 162.77 31.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.05 0.453 . . . . 10.0 111.795 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -94.84 114.72 26.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 178.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.4 m -129.54 156.74 42.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.974 0.416 . . . . 10.0 111.246 -179.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.5 p -96.83 122.3 39.65 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.04 0.447 . . . . 10.0 110.627 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -63.92 111.23 2.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.962 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 58.93 27.97 16.95 Favored 'General case' 0 N--CA 1.463 0.179 0 O-C-N 123.806 0.691 . . . . 10.0 110.44 -178.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.1 t70 64.76 25.64 12.97 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.232 -0.895 . . . . 10.0 110.891 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.69 -80.22 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.335 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -98.32 123.74 49.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.541 0.21 . . . . 10.0 111.41 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 74.4 Cg_endo -81.05 123.86 4.72 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.997 2.464 . . . . 10.0 111.685 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -143.85 168.69 19.35 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.87 136.77 32.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.58 129.33 15.18 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.801 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -108.73 122.62 63.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.251 0.548 . . . . 10.0 109.579 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.445 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.1 mtt85 -146.45 176.16 10.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.42 0.629 . . . . 10.0 111.977 -177.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.537 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -117.38 131.28 56.8 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 114.799 -1.091 . . . . 10.0 109.718 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.0 m0 -117.26 177.52 4.7 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.757 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -72.96 155.39 90.52 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.57 -24.07 70.19 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.195 1.93 . . . . 10.0 112.068 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -98.05 -0.86 43.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.861 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.2 m170 61.34 20.88 11.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.405 -0.816 . . . . 10.0 110.703 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.42 ' H ' ' HG2' ' A' ' 49' ' ' GLU . 12.2 pt-20 -71.7 -39.34 70.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.033 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -135.35 174.3 10.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.224 0.535 . . . . 10.0 111.194 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.74 171.79 13.61 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.183 -0.917 . . . . 10.0 110.407 -177.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.91 -161.74 8.99 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.637 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.5 mttp -99.94 145.87 27.33 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -145.41 -121.01 1.38 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 111.08 -0.808 . . . . 10.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 12.7 tt -148.84 142.55 18.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.521 0.66 . . . . 10.0 111.14 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -101.73 136.84 40.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.833 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.4 mt -117.09 120.48 38.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.925 0.393 . . . . 10.0 110.27 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.502 ' HB3' ' HG2' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -80.6 172.49 13.69 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.502 179.586 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -58.22 -43.05 87.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 10.0 111.503 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.572 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.2 pt-20 -54.44 -47.38 72.95 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.39 0.614 . . . . 10.0 110.509 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.572 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 26.7 mt-10 -68.23 -58.64 4.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.052 -0.977 . . . . 10.0 111.326 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.629 ' CE2' HD11 ' A' ' 66' ' ' LEU . 10.1 t80 -49.82 -44.83 49.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.401 -0.818 . . . . 10.0 111.867 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.87 -58.5 13.42 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.229 -0.51 . . . . 10.0 113.181 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -65.17 -40.93 90.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.883 0.373 . . . . 10.0 111.296 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.477 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.1 tp -58.24 -53.84 53.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.958 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.629 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.1 mt -61.92 -43.84 98.01 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.106 -0.237 . . . . 10.0 111.356 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.1 tttm -50.76 -53.31 32.75 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 123.616 0.572 . . . . 10.0 111.07 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.514 ' CB ' HD12 ' B' ' 14' ' ' ILE . 25.2 mm-40 -72.07 -44.56 63.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.706 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 44.0 mt -59.43 -44.0 92.98 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.424 0.157 . . . . 10.0 111.424 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.4 94.67 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.459 -0.876 . . . . 10.0 110.987 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.75 -28.15 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.702 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 72.3 mmtt -68.54 -30.7 69.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.285 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.499 HD11 ' HB3' ' B' ' 66' ' ' LEU . 19.4 mt -88.49 2.56 52.62 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.243 -0.183 . . . . 10.0 111.419 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.471 -0.776 . . . . 10.0 110.309 179.857 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.3 mmt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.915 0.388 . . . . 10.0 110.18 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.24 163.47 13.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.322 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.426 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 4.6 t70 -66.32 -60.37 2.83 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.426 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 35.1 mmtm -132.5 104.64 6.79 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 37.3 tp -77.56 142.71 38.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.814 0.34 . . . . 10.0 110.692 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -79.36 136.27 36.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.078 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -160.11 174.77 13.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.681 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.449 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 13.5 tp10 -158.64 126.57 5.14 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.059 -0.348 . . . . 10.0 110.059 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.403 ' HA ' HG12 ' B' ' 30' ' ' VAL . 71.9 mt -76.0 114.55 16.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.064 0.459 . . . . 10.0 110.156 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 32.0 mm -86.99 -41.26 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.428 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -164.48 127.53 2.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.771 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -76.52 142.89 40.72 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.4 mt -111.75 -72.55 0.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.521 -0.472 . . . . 10.0 111.861 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.514 HD12 ' CB ' ' A' ' 68' ' ' GLU . 21.5 mm -131.5 144.2 38.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 10.0 111.496 -177.554 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.415 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -129.16 123.36 58.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 177.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 26.5 mt -92.3 -80.81 0.36 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.905 -0.318 . . . . 10.0 111.445 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 176.59 -172.05 0.09 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.302 0.641 . . . . 10.0 109.386 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.447 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.9 mp0 -101.34 150.87 22.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 19' ' ' ASN . . . . . 0.4 ' CG ' ' H ' ' B' ' 20' ' ' ALA . 18.0 t-20 -90.91 -174.51 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.781 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 20' ' ' ALA . . . . . 0.4 ' H ' ' CG ' ' B' ' 19' ' ' ASN . . . -63.82 -23.83 67.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.453 0.644 . . . . 10.0 110.596 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -91.06 1.49 57.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.287 -0.869 . . . . 10.0 110.314 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.34 -1.21 87.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.389 -178.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.511 ' HB3' ' CG2' ' B' ' 43' ' ' THR . 40.3 m0 -56.68 107.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.61 109.58 15.27 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 25' ' ' LYS . . . . . 0.445 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 80.8 mttt -86.36 111.58 20.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.611 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.415 ' HG2' HG23 ' B' ' 15' ' ' VAL . 50.2 mt-10 -138.21 157.14 46.88 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.568 0.699 . . . . 10.0 112.138 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.784 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.4 tp -128.88 111.02 12.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.742 -1.117 . . . . 10.0 108.192 178.657 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -135.57 161.03 36.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.037 0.446 . . . . 10.0 111.435 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 ttm-85 -93.03 114.67 27.29 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.35 -0.981 . . . . 10.0 108.35 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' B' ' 9' ' ' ILE . 18.3 m -128.87 154.99 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.948 0.404 . . . . 10.0 111.076 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.499 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.5 p -95.63 122.72 38.69 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.972 0.415 . . . . 10.0 110.513 179.226 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -63.99 112.39 2.93 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.82 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 57.58 28.13 15.18 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.708 0.63 . . . . 10.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 62.95 30.45 16.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.963 -1.017 . . . . 10.0 110.884 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.77 -79.07 0.58 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.102 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -99.05 122.06 53.66 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.532 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 65.7 Cg_endo -79.78 122.52 4.94 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.716 2.277 . . . . 10.0 111.709 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -142.99 166.57 24.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -87.41 135.65 33.25 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.5 t0 -147.41 128.57 14.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.784 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.1 tt -107.34 123.25 62.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.426 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -146.23 175.05 10.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.494 0.664 . . . . 10.0 112.119 -177.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.511 ' CG2' ' HB3' ' B' ' 23' ' ' TRP . 0.0 OUTLIER -117.45 131.59 56.71 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.728 -1.124 . . . . 10.0 109.887 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 18.0 m0 -117.56 177.99 4.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.56 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.9 m -74.21 155.44 88.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.17 -31.21 89.87 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.073 1.849 . . . . 10.0 112.145 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.14 -3.8 57.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.195 179.31 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 m170 64.15 24.7 13.52 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.489 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.68 -39.64 61.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.138 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -133.97 174.3 10.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.136 0.493 . . . . 10.0 110.834 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.74 168.82 18.94 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.573 -177.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.04 -163.79 10.23 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.704 -0.76 . . . . 10.0 112.664 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mttp -98.59 144.84 27.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.38 0.511 . . . . 10.0 112.38 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.52 -118.54 1.31 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.8 tt -152.56 142.35 14.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.413 0.607 . . . . 10.0 110.919 179.16 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.6 m -102.44 135.42 44.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.475 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 68.8 mt -115.75 121.23 41.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.871 0.367 . . . . 10.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.9 m -80.45 174.01 12.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.582 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -59.26 -40.78 87.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.838 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 8.5 pt-20 -55.55 -46.67 77.11 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.606 0.717 . . . . 10.0 110.432 178.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.653 ' HA ' HD13 ' A' ' 16' ' ' LEU . 31.6 mt-10 -68.54 -58.62 4.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.021 -0.991 . . . . 10.0 111.202 -179.226 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -53.83 -39.18 65.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.822 -178.529 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.32 -59.65 9.59 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.918 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.589 ' HB ' HD22 ' A' ' 16' ' ' LEU . 8.9 t -67.19 -41.04 86.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.627 0.251 . . . . 10.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.58 -53.59 56.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.094 -179.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.499 ' HB3' HD11 ' A' ' 73' ' ' LEU . 45.3 mt -59.01 -49.12 79.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.238 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -50.19 -54.19 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.662 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.668 ' HB3' HD12 ' A' ' 14' ' ' ILE . 21.7 mm-40 -69.38 -46.53 66.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.856 -0.611 . . . . 10.0 112.056 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.615 ' HB3' HD22 ' A' ' 66' ' ' LEU . 46.8 mt -60.57 -43.86 96.82 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.127 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.04 94.11 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.717 -0.953 . . . . 10.0 110.717 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.19 -23.6 61.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.365 -0.418 . . . . 10.0 111.185 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.6 mmtt -70.06 -29.82 66.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.185 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.421 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.5 mt -90.31 4.52 50.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.563 0.22 . . . . 10.0 111.411 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.907 -0.568 . . . . 10.0 109.866 179.071 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.6 mmm . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 120.869 0.366 . . . . 10.0 110.228 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.44 154.68 18.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.903 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.475 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 24.3 t70 -60.15 -52.8 63.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.124 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.475 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 24.4 mmtm -137.8 106.41 5.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.859 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.0 tp -82.93 137.3 34.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.081 -0.34 . . . . 10.0 110.081 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -73.23 134.52 44.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.279 -0.418 . . . . 10.0 110.889 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -159.83 168.29 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.257 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.509 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.5 tp10 -147.49 135.22 21.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.145 178.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.465 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.7 mt -83.68 106.69 14.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.433 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.448 HG13 ' HB3' ' A' ' 37' ' ' PRO . 37.2 mm -77.11 -56.51 7.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.937 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -157.83 126.79 5.71 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.062 -179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -73.46 142.61 46.85 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.1 mt -110.69 -75.65 0.62 Allowed 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.368 -0.533 . . . . 10.0 111.539 -178.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.635 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.9 mm -131.03 136.95 56.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.162 0.506 . . . . 10.0 111.741 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.542 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.3 p -117.23 123.18 71.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.246 -1.02 . . . . 10.0 108.246 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -90.45 -80.87 0.32 Allowed 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.764 -0.374 . . . . 10.0 111.308 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.3 m 176.59 -179.13 0.17 Allowed 'General case' 0 C--O 1.235 0.34 0 C-N-CA 122.952 0.501 . . . . 10.0 110.006 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 45.1 mp0 -95.09 164.46 12.86 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.02 -167.69 1.25 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.307 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.48 -25.71 68.14 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 10.0 110.556 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -91.56 0.24 57.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.146 -0.933 . . . . 10.0 110.728 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 -1.56 88.57 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.811 -0.709 . . . . 10.0 111.492 -178.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.508 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.0 m0 -53.05 105.64 0.13 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.569 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.0 tpp85 -80.37 100.16 8.3 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 178.43 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -81.57 112.02 18.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.675 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.542 ' HG2' HG23 ' A' ' 15' ' ' VAL . 54.3 mt-10 -137.98 152.4 48.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.372 0.606 . . . . 10.0 111.58 -179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.78 HD13 ' HB ' ' A' ' 41' ' ' ILE . 34.2 tp -122.99 107.65 12.05 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -134.28 157.76 45.5 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.478 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -97.12 114.32 25.99 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.465 HG12 ' HA ' ' A' ' 9' ' ' ILE . 15.7 m -125.41 162.04 28.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.795 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.509 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -98.78 123.97 43.36 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.95 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -64.28 112.28 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.982 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.42 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.6 m-80 58.72 28.93 17.96 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.681 0.613 . . . . 10.0 110.447 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.7 t70 64.23 27.69 13.91 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.128 -0.942 . . . . 10.0 110.648 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.47 -82.61 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.366 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 31' ' ' SER . 35.7 tt0 -89.19 120.5 69.82 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.556 -178.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.448 ' HB3' HG13 ' A' ' 10' ' ' ILE . 33.8 Cg_endo -82.93 120.64 3.06 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.664 2.243 . . . . 10.0 111.111 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.441 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 16.3 ttpt -148.19 160.73 42.63 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.216 -0.29 . . . . 10.0 110.216 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -81.63 140.0 34.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.628 -0.26 . . . . 10.0 110.692 -178.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.407 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -150.4 133.9 16.49 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.78 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.6 tt -111.86 122.75 66.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.118 0.485 . . . . 10.0 109.92 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.407 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.4 mtt85 -148.14 171.19 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.495 -177.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.569 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.7 p -121.31 134.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -118.76 177.97 4.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.541 0.21 . . . . 10.0 110.872 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.7 m -63.38 151.81 86.59 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.837 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.04 -30.73 83.27 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.528 2.152 . . . . 10.0 111.88 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -91.11 -3.03 57.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.253 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 64.25 24.83 13.44 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.716 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.37 -34.05 61.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.008 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -141.33 174.45 10.53 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.347 0.594 . . . . 10.0 111.722 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.93 172.62 10.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.761 -1.109 . . . . 10.0 110.944 -178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -140.58 -171.71 12.6 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 121.062 -0.59 . . . . 10.0 112.475 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.8 mttp -99.0 144.33 28.28 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 121.979 -0.718 . . . . 10.0 112.446 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.4 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -143.59 -120.38 1.47 Allowed Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.577 -1.009 . . . . 10.0 110.577 178.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -149.18 142.65 18.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 117.513 0.656 . . . . 10.0 110.818 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.2 m -97.47 139.79 32.88 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.973 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.7 mt -115.8 118.77 33.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.913 0.387 . . . . 10.0 110.594 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -77.5 167.28 21.91 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.8 -39.88 86.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.779 0.323 . . . . 10.0 110.399 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.431 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 6.7 pt-20 -56.63 -46.93 80.68 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.253 178.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 31.5 mt-10 -67.81 -56.37 9.42 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.786 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.702 ' CE2' HD11 ' A' ' 66' ' ' LEU . 7.8 t80 -49.72 -47.95 50.29 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.029 0.831 . . . . 10.0 111.776 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.94 -56.46 25.19 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.39 -0.433 . . . . 10.0 113.382 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.1 t -67.28 -42.33 87.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.82 0.343 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 17.5 tp -58.53 -53.38 58.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.016 -178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.719 HD22 ' HB3' ' B' ' 69' ' ' LEU . 21.2 mt -61.26 -44.41 97.28 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.38 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.7 tttm -52.19 -53.49 42.69 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.046 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.619 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 54.5 mm-40 -70.09 -47.88 59.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.702 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.522 ' HB3' HD22 ' B' ' 66' ' ' LEU . 59.0 mt -58.27 -45.46 87.83 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.633 0.234 . . . . 10.0 111.633 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.3 -35.04 91.46 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.565 -0.826 . . . . 10.0 111.396 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -73.48 -28.72 62.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.491 -0.354 . . . . 10.0 110.859 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.619 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 52.1 mmtt -68.88 -23.4 64.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.986 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.588 HD11 ' HB3' ' B' ' 66' ' ' LEU . 27.3 mt -89.86 -14.35 34.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.868 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.851 -0.595 . . . . 10.0 110.462 -179.642 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 31.9 mmm . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.689 0.28 . . . . 10.0 110.605 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.72 161.04 13.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 3' ' ' ASP . . . . . 0.44 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 23.2 t70 -66.79 -52.73 40.54 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 4' ' ' LYS . . . . . 0.44 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 31.6 mmtm -136.98 104.95 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.031 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 37.4 tp -82.18 133.67 35.27 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 179.183 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.8 tppt? -72.47 133.14 44.69 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.072 0.463 . . . . 10.0 111.282 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -158.35 170.02 23.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.554 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.483 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.0 tp10 -147.32 133.64 19.55 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 9' ' ' ILE . . . . . 0.532 ' HA ' HG12 ' B' ' 30' ' ' VAL . 50.9 mt -81.63 105.0 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.98 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 47.3 mm -75.34 -56.93 7.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.071 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -157.58 130.33 7.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.981 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.92 141.31 40.56 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.922 -0.77 . . . . 10.0 108.922 178.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 44.0 mt -110.27 -74.09 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.439 -0.504 . . . . 10.0 111.664 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.506 HD12 ' CB ' ' A' ' 68' ' ' GLU . 19.5 mm -130.29 136.79 57.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.046 0.45 . . . . 10.0 111.714 -177.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.468 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -118.48 120.45 64.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -87.43 -81.15 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.719 -0.392 . . . . 10.0 111.41 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m 176.07 -177.99 0.13 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.017 0.527 . . . . 10.0 109.922 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 36.7 mp0 -96.81 163.92 12.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.15 -166.61 1.13 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.461 -0.2 . . . . 10.0 110.461 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.85 -26.76 68.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.388 0.613 . . . . 10.0 110.89 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -92.04 0.41 57.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.322 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.51 -0.23 89.7 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.632 -0.794 . . . . 10.0 111.666 -178.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' TRP . . . . . 0.513 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -52.72 106.28 0.15 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 112.03 0.382 . . . . 10.0 112.03 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.535 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.3 tpp85 -80.59 100.25 8.52 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -81.59 112.19 18.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.755 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.468 ' HG2' HG23 ' B' ' 15' ' ' VAL . 53.8 mt-10 -138.21 152.94 49.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.387 0.613 . . . . 10.0 111.811 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.753 HD13 ' HB ' ' B' ' 41' ' ' ILE . 36.8 tp -123.08 107.56 11.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.008 -1.108 . . . . 10.0 108.008 178.278 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -134.45 157.28 46.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.565 -0.289 . . . . 10.0 110.714 -178.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -96.67 114.97 26.66 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' B' ' 9' ' ' ILE . 19.4 m -126.69 160.99 34.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.665 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -97.28 124.54 41.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.079 0.466 . . . . 10.0 111.094 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -64.46 111.75 2.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.008 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.4 m-80 58.4 30.63 19.9 Favored 'General case' 0 CA--C 1.521 -0.139 0 O-C-N 123.802 0.689 . . . . 10.0 110.361 -178.198 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.4 t0 61.0 33.01 19.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.986 -1.006 . . . . 10.0 110.565 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.46 -78.72 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.923 -0.58 . . . . 10.0 111.289 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -92.41 117.55 67.68 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.432 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.4 Cg_endo -81.0 119.98 3.67 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.592 2.195 . . . . 10.0 111.279 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ttpt -148.36 161.62 41.2 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.035 -0.266 . . . . 10.0 110.436 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -81.17 139.53 35.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.876 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.412 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -150.71 132.61 15.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 41' ' ' ILE . . . . . 0.753 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.8 tt -110.25 122.87 65.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-O 121.246 0.546 . . . . 10.0 110.193 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.412 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.1 mtt85 -147.88 170.58 17.35 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.661 -177.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 43' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.5 p -120.53 134.17 55.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m0 -118.03 177.75 4.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.789 -0.187 . . . . 10.0 110.973 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -66.11 151.04 96.15 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.675 -0.239 . . . . 10.0 110.372 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.61 -33.34 96.81 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.569 2.18 . . . . 10.0 111.793 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -87.15 -5.03 59.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.289 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 66.48 21.0 10.87 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.586 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -70.49 -37.87 74.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.956 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -137.79 174.17 10.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.495 0.664 . . . . 10.0 112.293 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.58 172.09 11.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.743 -1.117 . . . . 10.0 110.72 -178.291 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -140.14 -170.18 11.92 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 121.034 -0.603 . . . . 10.0 112.248 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -99.7 142.2 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.987 -0.714 . . . . 10.0 112.53 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.406 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -140.01 -120.64 1.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 110.209 -1.156 . . . . 10.0 110.209 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.3 tt -150.06 143.26 17.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.413 0.607 . . . . 10.0 110.565 179.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m -97.0 140.0 32.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.271 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -116.5 117.71 30.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.845 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -76.22 166.67 23.13 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.22 -39.24 85.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 10.0 110.166 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 60' ' ' GLU . . . . . 0.416 ' HG3' ' N ' ' B' ' 61' ' ' GLU . 7.0 pt-20 -56.88 -44.98 82.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.44 -0.8 . . . . 10.0 110.381 177.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' B' ' 60' ' ' GLU . 33.8 mt-10 -69.63 -56.37 7.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.454 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.552 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.2 t80 -52.25 -44.5 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.82 0.7 . . . . 10.0 111.332 -179.299 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.81 -55.44 30.85 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.907 -0.663 . . . . 10.0 113.128 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.8 t -68.99 -44.18 81.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.895 0.378 . . . . 10.0 111.228 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.25 -52.45 65.27 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.007 -178.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 66' ' ' LEU . . . . . 0.588 ' HB3' HD11 ' A' ' 73' ' ' LEU . 29.8 mt -59.03 -50.75 72.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.775 0.322 . . . . 10.0 110.742 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -50.08 -55.33 15.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.934 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 68' ' ' GLU . . . . . 0.635 ' HB3' HD12 ' A' ' 14' ' ' ILE . 40.6 mm-40 -67.95 -49.67 60.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.983 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.719 ' HB3' HD22 ' A' ' 66' ' ' LEU . 64.7 mt -58.86 -45.4 90.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.613 0.227 . . . . 10.0 111.613 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.64 -36.72 93.65 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.616 -0.802 . . . . 10.0 111.15 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -73.59 -28.02 61.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.938 0.399 . . . . 10.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.4 mmtt -66.81 -25.93 66.69 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.87 0.367 . . . . 10.0 110.689 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.437 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.5 mt -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.313 179.653 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.77 -0.633 . . . . 10.0 110.205 179.739 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.8 mmm . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 121.001 0.429 . . . . 10.0 110.084 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.06 160.16 25.91 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.383 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -64.16 -49.41 72.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 10.0 110.25 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -134.55 108.32 8.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.098 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.735 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 32.6 tp -82.77 134.7 35.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.095 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -70.31 139.18 52.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.93 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.622 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 13.5 p90 -166.57 175.08 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.488 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -158.51 134.01 8.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.628 ' HA ' HG12 ' A' ' 30' ' ' VAL . 52.2 mt -80.79 111.82 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.9 mm -83.4 -45.96 18.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.591 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -159.31 132.43 7.04 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.107 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.0 127.44 33.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 75.9 mt -99.99 -74.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.474 -0.49 . . . . 10.0 111.931 -178.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.638 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.2 mm -130.09 144.16 38.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.086 0.469 . . . . 10.0 112.212 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.487 HG23 ' HG2' ' A' ' 26' ' ' GLU . 4.3 p -124.48 123.86 67.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.324 -0.991 . . . . 10.0 108.324 177.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.2 mt -91.02 -80.36 0.34 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.366 -0.534 . . . . 10.0 111.046 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 175.51 -177.42 0.11 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.086 0.554 . . . . 10.0 109.782 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.488 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 36.4 mp0 -97.26 164.08 12.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.38 -166.4 1.08 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -29.23 70.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.395 0.617 . . . . 10.0 109.874 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -87.91 -1.84 58.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.21 -0.905 . . . . 10.0 110.309 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.64 0.15 89.23 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.672 -0.775 . . . . 10.0 112.041 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.488 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.6 m0 -52.95 107.07 0.19 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 122.493 0.317 . . . . 10.0 111.794 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 43' ' ' THR . 14.7 tpp85 -79.97 100.28 8.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -82.59 112.75 19.76 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.751 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG2' HG23 ' A' ' 15' ' ' VAL . 45.6 mt-10 -139.25 161.67 36.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.638 0.733 . . . . 10.0 111.975 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.775 HD13 ' HB ' ' A' ' 41' ' ' ILE . 35.3 tp -130.37 108.07 9.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.569 -1.196 . . . . 10.0 108.521 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -135.62 157.38 47.01 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.832 0.349 . . . . 10.0 110.508 -178.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 29' ' ' ARG . 8.6 ttp180 -97.51 114.66 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.628 HG12 ' HA ' ' A' ' 9' ' ' ILE . 23.9 m -124.69 162.16 27.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.769 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 2.4 p -95.31 122.23 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.925 0.393 . . . . 10.0 110.635 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.1 m0 -63.86 109.46 1.76 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.768 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 60.11 29.55 19.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.931 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 t0 61.63 35.11 17.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.803 -1.09 . . . . 10.0 110.715 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.64 -76.8 0.58 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.01 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -92.48 116.16 66.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 61.3 Cg_endo -81.63 120.6 3.56 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.514 2.143 . . . . 10.0 111.049 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -149.88 159.55 44.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.686 0.279 . . . . 10.0 110.48 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.505 ' HD1' HD11 ' A' ' 13' ' ' LEU . 1.0 OUTLIER -78.68 133.95 37.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.895 -179.347 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -144.43 129.01 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.775 ' HB ' HD13 ' A' ' 27' ' ' LEU . 12.8 tt -106.13 122.44 59.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.289 0.566 . . . . 10.0 110.486 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.589 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.8 mtp85 -149.14 174.27 12.52 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.252 -178.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.565 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.8 p -124.19 138.44 54.41 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.625 -0.879 . . . . 10.0 108.625 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -117.89 176.92 4.98 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 121.081 -0.248 . . . . 10.0 110.987 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -66.13 150.7 96.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.365 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.04 -38.16 96.59 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.91 2.407 . . . . 10.0 112.65 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -88.11 5.7 39.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.893 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 57.86 28.05 15.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.277 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -81.03 -31.91 34.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.451 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -140.71 174.79 10.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 10.0 111.587 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.79 172.59 10.69 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.012 -0.994 . . . . 10.0 110.929 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.644 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -138.35 -170.26 11.81 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.734 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.431 ' HA ' ' NH2' ' A' ' 42' ' ' ARG . 22.4 mttp -103.62 141.77 35.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 10.0 112.301 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.46 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -141.0 -117.46 1.37 Allowed Glycine 0 N--CA 1.453 -0.192 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -152.78 142.12 14.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 117.381 0.591 . . . . 10.0 110.976 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 m -96.77 135.13 39.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.333 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 65.3 mt -115.02 117.44 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -78.58 169.96 17.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.567 -0.288 . . . . 10.0 110.558 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -57.38 -44.86 84.78 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.164 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.457 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 7.4 pt-20 -54.97 -45.04 74.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.854 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.457 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 34.8 mt-10 -69.26 -59.77 2.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.008 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.647 ' CE2' HD11 ' A' ' 66' ' ' LEU . 3.5 t80 -52.32 -42.15 63.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.73 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.68 -59.68 10.33 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.233 -0.508 . . . . 10.0 112.648 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 72.3 t -64.63 -41.28 91.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.99 0.424 . . . . 10.0 110.604 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.528 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.1 tp -57.67 -54.24 49.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.807 -179.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.704 ' HB3' HD11 ' B' ' 73' ' ' LEU . 17.2 mt -62.37 -43.24 99.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.702 -0.226 . . . . 10.0 111.464 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -53.43 -50.77 64.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.196 0.522 . . . . 10.0 110.733 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.625 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 41.8 mm-40 -71.5 -48.82 46.53 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.384 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.8 mt -57.37 -45.45 84.43 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.742 0.275 . . . . 10.0 111.742 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.69 -38.06 95.28 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 111.322 -0.711 . . . . 10.0 111.322 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -73.51 -25.21 60.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.869 0.366 . . . . 10.0 110.758 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.625 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.82 -29.02 68.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.883 0.373 . . . . 10.0 110.685 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.648 HD11 ' HB3' ' B' ' 66' ' ' LEU . 36.9 mt -87.72 3.14 49.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.146 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 C--O 1.252 1.184 0 CA-C-O 118.607 -0.711 . . . . 10.0 109.998 179.495 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mmm . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.916 0.389 . . . . 10.0 110.58 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.44 161.22 16.38 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.487 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.528 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 26.7 t70 -64.13 -50.26 68.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.183 0.516 . . . . 10.0 109.754 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.528 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 40.7 mmtm -135.02 109.88 8.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.672 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.711 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 35.7 tp -83.88 135.82 34.35 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.992 -0.373 . . . . 10.0 109.992 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.405 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.2 tppt? -71.34 137.37 48.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.161 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.692 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 11.8 p90 -164.59 177.25 8.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.256 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -159.88 131.97 6.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.521 ' HA ' HG12 ' B' ' 30' ' ' VAL . 51.4 mt -78.37 108.87 12.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 10.0 110.697 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.3 mm -80.02 -50.23 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.139 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -156.51 130.75 8.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.949 -0.568 . . . . 10.0 111.237 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.08 132.14 35.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.506 HD11 ' HD1' ' B' ' 39' ' ' TYR . 57.4 mt -103.87 -71.42 0.73 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.648 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.562 HD12 ' CB ' ' A' ' 68' ' ' GLU . 19.8 mm -131.8 142.37 43.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.978 0.418 . . . . 10.0 111.946 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.431 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.8 p -124.26 121.51 61.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.277 -1.009 . . . . 10.0 108.277 177.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 37.0 mt -88.24 -80.54 0.27 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.615 -0.434 . . . . 10.0 111.489 -178.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 175.25 -178.01 0.11 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.487 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 35.3 mp0 -97.15 163.76 12.79 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.77 -164.01 0.89 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.921 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.33 -23.57 64.72 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.294 0.568 . . . . 10.0 110.3 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -93.8 -0.35 55.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.937 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.39 0.03 89.36 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.829 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.487 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.5 m0 -53.59 107.62 0.27 Allowed 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.56 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.1 tpp85 -80.46 100.2 8.39 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -81.5 113.19 19.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.857 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.431 ' HG2' HG23 ' B' ' 15' ' ' VAL . 50.5 mt-10 -139.74 162.03 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.519 0.676 . . . . 10.0 112.037 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.757 HD13 ' HB ' ' B' ' 41' ' ' ILE . 32.8 tp -131.76 107.14 8.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.725 -1.125 . . . . 10.0 108.517 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -135.5 155.95 49.68 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.634 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -96.18 114.53 26.24 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' B' ' 9' ' ' ILE . 17.0 m -122.91 162.19 23.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.443 -179.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.0 p -94.97 121.96 37.13 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.949 0.404 . . . . 10.0 110.373 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' TRP . . . . . 0.531 ' CH2' ' H72' ' C' ' 17' ' ' ' DT' . 6.7 m0 -63.63 109.92 1.84 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.661 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.405 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.9 m-80 60.54 28.14 17.81 Favored 'General case' 0 N--CA 1.462 0.14 0 O-C-N 123.781 0.676 . . . . 10.0 110.115 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.0 t70 65.91 25.29 11.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.585 -1.189 . . . . 10.0 110.982 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.74 -78.41 0.58 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.13 -0.356 . . . . 10.0 111.916 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -87.48 117.17 68.2 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.775 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 58.9 Cg_endo -82.82 119.45 2.91 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.143 1.896 . . . . 10.0 110.971 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.455 ' HE3' HG21 ' B' ' 56' ' ' THR . 12.3 ttpt -148.51 158.38 44.08 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 121.01 -0.276 . . . . 10.0 110.471 -178.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' TYR . . . . . 0.506 ' HD1' HD11 ' B' ' 13' ' ' LEU . 1.2 m-85 -78.6 133.08 37.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.457 -179.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -143.72 129.25 19.09 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.757 ' HB ' HD13 ' B' ' 27' ' ' LEU . 12.1 tt -106.67 122.5 60.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.287 0.565 . . . . 10.0 110.525 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.601 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.2 mtp85 -149.23 175.07 11.71 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.332 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.56 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.4 p -125.17 138.3 54.14 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.8 m-90 -117.88 176.87 5.0 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.921 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.8 m -64.99 150.79 94.76 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.581 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.39 -42.27 69.93 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.788 2.325 . . . . 10.0 112.408 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -88.36 11.75 15.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.117 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 53.48 33.35 15.89 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.563 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -84.02 -32.79 24.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.371 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -141.32 174.31 10.66 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.325 0.584 . . . . 10.0 111.351 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.27 173.05 9.58 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.711 -1.131 . . . . 10.0 110.646 -178.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.614 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -139.72 -169.21 11.56 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.979 -0.629 . . . . 10.0 112.578 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' LYS . . . . . 0.431 ' HA ' ' NH2' ' B' ' 42' ' ' ARG . 18.3 mttp -102.26 144.59 30.58 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.237 0.541 . . . . 10.0 112.033 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -144.18 -120.25 1.41 Allowed Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 110.73 -0.948 . . . . 10.0 110.73 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -151.65 142.38 15.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 117.309 0.555 . . . . 10.0 110.603 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.455 HG21 ' HE3' ' B' ' 38' ' ' LYS . 2.5 m -96.55 136.09 37.54 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.648 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.83 117.53 30.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.324 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.65 171.18 15.51 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.664 -0.243 . . . . 10.0 110.534 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -58.39 -44.83 89.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.98 0.419 . . . . 10.0 110.323 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.456 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.4 pt-20 -55.13 -45.03 75.58 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.894 178.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.456 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 33.5 mt-10 -70.25 -60.52 2.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.936 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.527 ' CE2' HD11 ' B' ' 66' ' ' LEU . 1.6 t80 -52.83 -38.27 61.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.658 -0.701 . . . . 10.0 111.553 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.96 -57.9 16.41 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.157 -0.544 . . . . 10.0 112.616 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 43.4 t -66.76 -40.07 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.442 . . . . 10.0 110.423 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.0 tp -58.21 -53.18 61.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.604 -0.725 . . . . 10.0 111.03 -179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.648 ' HB3' HD11 ' A' ' 73' ' ' LEU . 55.9 mt -60.3 -49.89 75.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.273 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.7 tttm -50.78 -51.58 49.16 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.464 0.477 . . . . 10.0 111.657 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.638 ' HB3' HD12 ' A' ' 14' ' ' ILE . 21.9 mm-40 -70.41 -49.2 51.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.71 -179.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.604 ' HB3' HD22 ' A' ' 66' ' ' LEU . 60.8 mt -59.81 -42.74 94.15 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.49 -39.4 97.78 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -72.88 -25.44 61.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.065 0.459 . . . . 10.0 111.037 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.6 mmtt -66.44 -29.67 69.86 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.997 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.704 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.1 mt -90.97 5.15 49.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.999 -0.28 . . . . 10.0 111.395 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 . . . . . 0 C--O 1.25 1.102 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 178.117 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 C3'-C2'-C1' 101.701 -0.714 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . 0.54 ' H71' ' O ' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C3'-C2'-C1' 101.457 -0.888 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.861 0 O4'-C1'-C2' 104.074 -1.842 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.735 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C4'-C3'-C2' 101.331 -1.869 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.589 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.962 0 O4'-C4'-C3' 103.485 -2.115 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.85 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.434 1.049 0 C5'-C4'-O4' 113.17 2.356 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.889 0 C3'-C2'-C1' 101.18 -1.086 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 C3'-C2'-C1' 101.365 -0.954 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . 0.426 ' H71' ' O ' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 C5'-C4'-C3' 115.717 0.678 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.428 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 O4'-C1'-C2' 104.257 -1.676 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.711 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.791 0 O4'-C4'-C3' 103.604 -1.996 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.601 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.977 0 O4'-C4'-C3' 103.669 -1.931 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.864 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.953 0 C5'-C4'-O4' 113.237 2.398 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.531 ' H72' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.424 -0.973 0 C3'-C2'-C1' 101.049 -1.179 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.971 0.415 . . . . 10.0 110.653 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -111.11 173.22 6.44 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.56 -54.95 8.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -137.41 104.18 5.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.846 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.707 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.8 tp -73.46 145.97 45.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.164 179.025 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -76.12 131.53 39.47 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.055 0.455 . . . . 10.0 110.583 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.534 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 13.1 p90 -156.16 166.52 33.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.808 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.518 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.5 tp10 -150.95 124.35 8.92 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.505 -0.554 . . . . 10.0 109.505 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.2 mt -75.67 110.23 10.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.031 0.443 . . . . 10.0 110.106 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.5 mm -80.92 -43.34 20.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.43 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -164.22 128.13 2.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.972 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -76.45 135.22 39.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.587 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 95.9 mt -105.93 -74.84 0.64 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.78 -0.368 . . . . 10.0 111.809 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.665 HD12 ' HB3' ' B' ' 68' ' ' GLU . 23.8 mm -132.71 138.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.338 0.59 . . . . 10.0 112.318 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.01 119.8 59.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 107.693 -1.225 . . . . 10.0 107.693 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.491 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.7 mt -88.85 -80.85 0.28 Allowed 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.382 -0.527 . . . . 10.0 111.816 -178.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -175.67 -171.94 0.5 Allowed 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.443 -0.577 . . . . 10.0 109.443 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.7 mp0 -105.47 140.92 37.84 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -79.21 -170.78 2.4 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -26.03 68.27 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.566 0.698 . . . . 10.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HG2' ' C2 ' ' C' ' 1' ' ' ' DT' . 22.9 mttt -91.28 4.55 52.06 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.028 -0.987 . . . . 10.0 110.921 -179.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.22 7.27 87.95 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.454 -0.879 . . . . 10.0 110.98 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -62.14 101.4 0.22 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 10.0 111.416 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.414 ' HG3' ' HG3' ' A' ' 26' ' ' GLU . 16.7 tpp85 -81.48 103.25 11.09 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.932 -0.577 . . . . 10.0 109.671 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -86.5 113.29 22.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.798 0.333 . . . . 10.0 110.153 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.414 ' HG3' ' HG3' ' A' ' 24' ' ' ARG . 61.4 mt-10 -129.93 146.94 51.64 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.353 0.597 . . . . 10.0 111.464 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.587 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 26.3 tp -114.05 108.0 16.42 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.716 -1.216 . . . . 10.0 107.716 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -134.44 152.95 52.11 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.944 0.402 . . . . 10.0 111.27 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -86.67 114.65 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.77 158.3 41.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.941 0.401 . . . . 10.0 110.828 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.518 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.9 p -97.13 125.05 41.36 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.629 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.6 m0 -64.49 108.04 1.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.652 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.3 m-80 60.03 29.06 18.66 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 123.776 0.672 . . . . 10.0 110.488 -178.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.4 t70 66.75 18.0 10.64 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.928 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.6 -79.15 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.988 -0.445 . . . . 10.0 111.918 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -97.19 124.92 47.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -178.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.3 Cg_endo -83.85 121.81 2.91 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 123.017 2.478 . . . . 10.0 111.874 178.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.585 ' HD2' HG22 ' A' ' 56' ' ' THR . 13.8 ttmm -143.98 167.24 22.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -88.42 133.54 34.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.503 0.192 . . . . 10.0 110.746 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.499 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -146.89 130.09 16.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.467 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.6 tt -104.56 122.9 58.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.532 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.2 mtt85 -142.04 -178.38 5.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -177.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -113.44 142.17 46.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.962 -1.017 . . . . 10.0 112.02 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -123.7 164.3 19.39 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.48 -0.782 . . . . 10.0 109.007 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.2 p -78.37 158.89 76.01 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.27 -20.91 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.431 2.087 . . . . 10.0 112.283 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.28 0.53 25.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.177 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 56.26 37.01 28.43 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.647 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -90.62 -39.73 12.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.274 0.559 . . . . 10.0 109.975 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -134.04 174.64 10.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.344 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.447 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -147.88 172.94 13.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.963 -177.544 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.656 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -128.6 -162.17 10.91 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.319 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -98.9 152.13 20.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.671 . . . . 10.0 111.694 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -140.98 -122.32 1.85 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.326 -0.71 . . . . 10.0 111.326 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.9 tt -151.65 140.84 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.265 0.555 . . . . 10.0 111.154 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.585 HG22 ' HD2' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -99.79 144.3 29.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.17 -179.894 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.84 128.62 47.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.17 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.19 163.9 26.13 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.924 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -55.6 -48.51 74.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.854 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.32 -47.64 83.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 10.0 111.076 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -61.04 -45.39 94.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.67 ' CE2' HD11 ' A' ' 66' ' ' LEU . 26.9 t80 -60.94 -45.19 95.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.268 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.33 -52.22 53.98 Favored Glycine 0 N--CA 1.451 -0.3 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.722 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.4 t -62.25 -42.27 94.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.877 0.37 . . . . 10.0 110.478 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -58.12 -54.4 47.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.794 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.67 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -63.39 -43.09 98.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.15 -0.22 . . . . 10.0 111.578 -179.137 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.0 tttm -52.78 -51.33 61.13 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 26.0 mm-40 -71.03 -45.32 64.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.599 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.5 mt -59.19 -43.66 92.19 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.664 0.269 . . . . 10.0 111.099 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.68 -38.31 96.22 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.574 -0.822 . . . . 10.0 111.084 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -69.68 -28.76 66.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.996 0.426 . . . . 10.0 110.491 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.9 mmtt -68.71 -30.23 68.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.07 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.492 HD11 ' HB3' ' B' ' 66' ' ' LEU . 41.8 mt -86.17 -11.44 52.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.192 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.562 -0.732 . . . . 10.0 110.835 -179.821 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.751 0.31 . . . . 10.0 110.518 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.52 175.68 5.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.4 -55.08 6.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.046 0.451 . . . . 10.0 109.865 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' B' ' 4' ' ' LYS . 13.3 mmmm -136.54 103.65 5.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.543 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.705 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 25.3 tp -73.12 144.27 47.03 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.098 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.9 tppt? -75.8 128.56 35.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.331 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.613 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 12.9 p90 -153.52 165.84 34.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.119 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.51 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.6 tp10 -150.51 124.49 9.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.58 110.22 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.199 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -80.77 -41.49 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.335 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -164.71 129.23 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.927 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.68 137.89 39.67 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.419 -0.956 . . . . 10.0 108.419 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.564 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 95.1 mt -108.96 -73.15 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.022 -0.671 . . . . 10.0 111.997 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.502 HD12 ' CB ' ' A' ' 68' ' ' GLU . 15.3 mm -131.22 139.45 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.984 0.421 . . . . 10.0 111.848 -177.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.7 117.2 49.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 177.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -85.7 -80.8 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.798 -0.361 . . . . 10.0 111.677 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.1 m -179.21 -171.61 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 50.3 mp0 -103.08 142.77 33.55 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.131 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -81.21 -171.07 3.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.96 -0.563 . . . . 10.0 109.531 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -18.81 65.56 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.368 0.604 . . . . 10.0 110.918 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' LYS . . . . . 0.407 ' HG2' ' C2 ' ' C' ' 11' ' ' ' DT' . 17.7 mttt -97.84 3.99 49.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.308 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.94 6.28 86.93 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.509 -0.853 . . . . 10.0 111.293 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -62.04 102.53 0.29 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.911 0.386 . . . . 10.0 111.372 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.417 ' HG3' ' HG3' ' B' ' 26' ' ' GLU . 16.4 tpp85 -81.72 102.27 10.63 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.831 178.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.72 113.75 22.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.711 0.291 . . . . 10.0 110.299 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.417 ' HG3' ' HG3' ' B' ' 24' ' ' ARG . 53.0 mt-10 -130.87 147.67 52.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.241 0.543 . . . . 10.0 111.193 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.564 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 28.8 tp -115.22 107.87 15.86 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.908 -1.145 . . . . 10.0 107.908 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -133.72 154.11 51.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.867 0.365 . . . . 10.0 111.047 -177.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -88.05 114.19 24.42 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.361 -0.977 . . . . 10.0 108.361 178.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 16.2 m -127.37 158.1 38.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.791 0.329 . . . . 10.0 110.703 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.51 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.2 p -96.81 124.83 40.9 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.941 0.401 . . . . 10.0 110.565 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -63.97 108.68 1.56 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.574 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.477 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 61.9 m-80 58.66 30.69 20.24 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.369 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 36.0 t70 67.31 14.91 9.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.81 -1.087 . . . . 10.0 111.557 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.35 -81.35 0.47 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.053 0.39 . . . . 10.0 112.053 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -94.45 124.83 54.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.465 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 71.0 Cg_endo -83.14 124.13 3.7 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.743 2.296 . . . . 10.0 112.032 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.42 ' HB2' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -145.92 164.46 31.94 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -87.07 130.77 34.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.337 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.47 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.2 t0 -144.58 131.17 19.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.478 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.8 tt -105.22 123.0 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.601 HH21 H2'' ' C' ' 14' ' ' ' DT' . 2.9 mtp85 -142.33 -178.08 5.57 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.606 0.595 . . . . 10.0 112.606 -177.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -114.28 143.11 45.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.976 -1.011 . . . . 10.0 112.149 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 54.7 m95 -123.56 166.19 15.86 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.488 -0.778 . . . . 10.0 108.906 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -80.02 159.31 71.11 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.2 -26.1 67.96 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.578 2.186 . . . . 10.0 112.471 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -104.03 0.36 29.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.582 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER 58.84 37.29 24.89 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.577 -0.738 . . . . 10.0 111.766 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -89.87 -38.94 13.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.148 0.499 . . . . 10.0 110.384 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -134.86 174.35 10.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.321 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.453 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -147.01 173.07 12.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.929 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.652 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -128.98 -162.55 10.98 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.142 -0.552 . . . . 10.0 112.277 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -96.95 154.2 17.44 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.013 -0.698 . . . . 10.0 111.708 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.44 -122.62 1.77 Allowed Glycine 0 C--N 1.331 0.264 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.384 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.2 tt -152.53 139.84 13.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 117.276 0.538 . . . . 10.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.23 141.96 31.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.1 mt -124.61 126.24 45.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.157 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -73.81 164.56 26.48 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.385 -0.371 . . . . 10.0 110.149 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -58.4 -44.48 89.0 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.491 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.2 pt-20 -65.54 -43.92 88.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 10.0 110.793 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -64.82 -47.64 77.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.385 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.636 ' CE2' HD11 ' B' ' 66' ' ' LEU . 12.5 t80 -59.44 -40.22 86.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.799 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.72 -53.33 46.22 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.595 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.491 ' HB ' HD22 ' A' ' 16' ' ' LEU . 20.1 t -62.05 -42.15 93.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 120.924 0.392 . . . . 10.0 110.261 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.9 tp -58.28 -54.19 49.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.937 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.636 HD11 ' CE2' ' B' ' 62' ' ' PHE . 45.9 mt -61.17 -48.72 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.08 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -50.15 -53.86 24.71 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.75 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.665 ' HB3' HD12 ' A' ' 14' ' ' ILE . 24.3 mm-40 -69.22 -45.69 69.22 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.872 -178.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.473 HD13 ' CD2' ' A' ' 66' ' ' LEU . 70.8 mt -61.09 -42.34 98.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.612 0.244 . . . . 10.0 111.279 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.98 -38.13 96.09 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.673 -0.971 . . . . 10.0 110.673 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -70.09 -30.54 67.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.294 -0.453 . . . . 10.0 110.508 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.9 mmtt -65.65 -31.31 72.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.559 -0.291 . . . . 10.0 111.35 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.522 HD11 ' CB ' ' A' ' 66' ' ' LEU . 29.4 mt -90.36 -3.07 57.96 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.45 -0.786 . . . . 10.0 109.926 179.664 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . 0.434 ' C2 ' ' HG2' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 O5'-C5'-C4' 109.017 -0.845 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 101.335 -0.975 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -0.968 0 O4'-C1'-C2' 104.081 -1.835 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.709 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C4'-C3' 103.549 -2.051 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 O4'-C4'-C3' 103.41 -2.19 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.913 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.928 0 C5'-C4'-O4' 113.1 2.313 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.938 0 C3'-C2'-C1' 101.12 -1.128 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . 0.407 ' C2 ' ' HG2' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 101.038 -1.187 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.944 0 C5'-C4'-C3' 115.756 0.704 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.942 0 O4'-C1'-C2' 104.458 -1.493 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.705 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 O4'-C4'-C3' 103.483 -2.117 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 O4'-C4'-C3' 103.903 -1.697 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.878 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.825 0 C5'-C4'-O4' 113.213 2.383 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 101.051 -1.178 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 mmt . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.819 0.343 . . . . 10.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -93.01 169.46 10.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.698 -0.482 . . . . 10.0 109.698 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.99 -47.4 71.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.081 0.467 . . . . 10.0 110.005 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -137.51 113.92 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.148 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.72 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 24.5 tp -85.1 143.15 29.03 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -78.35 131.67 37.09 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.021 0.439 . . . . 10.0 110.376 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.526 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 12.9 p90 -152.14 171.57 17.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.798 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.543 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.2 tp10 -152.23 121.66 6.82 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.799 -0.445 . . . . 10.0 109.799 179.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.598 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.2 mt -79.37 105.7 9.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.904 0.383 . . . . 10.0 110.578 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.36 -51.96 19.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.184 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -162.72 130.54 3.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.141 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.92 144.17 41.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.664 -0.495 . . . . 10.0 109.664 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.493 ' O ' HD13 ' A' ' 14' ' ' ILE . 71.9 mt -109.28 -75.17 0.63 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.783 -0.367 . . . . 10.0 111.915 -178.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.76 HD12 ' HB3' ' B' ' 68' ' ' GLU . 32.1 mm -128.7 141.69 45.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -177.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.5 p -125.13 123.33 65.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.489 HD22 ' HB ' ' B' ' 64' ' ' VAL . 35.2 mt -92.24 -79.85 0.38 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.544 -0.462 . . . . 10.0 111.276 -178.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.09 -167.33 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.502 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.7 mp0 -108.53 145.38 34.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.769 0.318 . . . . 10.0 110.516 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -82.28 -173.46 4.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.31 -22.34 66.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.397 0.618 . . . . 10.0 110.509 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -88.62 -1.64 58.17 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.279 -0.873 . . . . 10.0 110.84 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 3.47 81.93 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.611 -0.804 . . . . 10.0 111.294 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.502 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.32 105.5 0.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.693 0.282 . . . . 10.0 111.355 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.4 tpp85 -85.47 100.31 11.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.458 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.2 mttt -82.45 115.84 21.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.617 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG2' HG23 ' A' ' 15' ' ' VAL . 83.5 mt-10 -134.68 147.31 50.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.792 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.61 HD13 ' HB ' ' A' ' 41' ' ' ILE . 35.9 tp -116.88 111.76 20.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.43 -0.805 . . . . 10.0 108.956 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -131.54 163.69 27.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 10.0 111.556 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -98.57 113.75 25.91 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.598 HG12 ' HA ' ' A' ' 9' ' ' ILE . 15.1 m -131.21 159.2 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.007 0.432 . . . . 10.0 111.269 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -96.65 125.14 40.91 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.145 178.821 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.1 m0 -63.81 108.99 1.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.525 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 58.21 31.93 21.4 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.481 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.8 t70 66.68 23.4 10.24 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 114.981 -1.009 . . . . 10.0 111.2 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.62 -88.27 0.46 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.102 -0.374 . . . . 10.0 111.745 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -95.57 124.88 51.51 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.547 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 59.6 Cg_endo -77.57 128.46 9.5 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.814 2.342 . . . . 10.0 111.851 178.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -147.94 170.06 18.52 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -94.98 131.21 41.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.213 -0.291 . . . . 10.0 110.213 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -142.42 132.01 23.91 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.61 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.5 tt -108.09 123.46 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.272 0.558 . . . . 10.0 110.059 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.528 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.4 mtt85 -145.79 177.41 8.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.133 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -124.64 142.55 51.3 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.458 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 28.7 m95 -117.56 171.14 8.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -65.55 156.92 80.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.23 -31.15 75.03 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.607 2.204 . . . . 10.0 112.618 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -97.28 2.79 51.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.178 0.513 . . . . 10.0 110.578 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 59.06 26.81 15.58 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.926 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -78.1 -37.07 47.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.116 0.484 . . . . 10.0 110.824 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -133.57 175.01 9.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.923 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.477 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -138.78 172.55 12.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.366 -0.834 . . . . 10.0 111.104 -177.088 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.735 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.85 -163.05 9.36 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.177 -0.535 . . . . 10.0 112.116 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -94.89 155.38 16.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.949 -0.736 . . . . 10.0 112.322 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.444 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.3 -127.05 1.43 Allowed Glycine 0 CA--C 1.518 0.245 0 N-CA-C 110.686 -0.966 . . . . 10.0 110.686 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -148.89 142.63 18.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 117.606 0.703 . . . . 10.0 111.198 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.47 141.15 34.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.839 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -122.09 129.4 52.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.962 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.1 m -74.23 164.97 25.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.013 -0.366 . . . . 10.0 110.013 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.47 -46.68 89.04 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.646 0.239 . . . . 10.0 111.646 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -61.96 -40.8 96.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 10.0 110.488 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.482 ' HB3' HD13 ' B' ' 16' ' ' LEU . 87.5 mt-10 -64.33 -49.79 70.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.357 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.761 ' CE2' HD11 ' A' ' 66' ' ' LEU . 15.1 t80 -57.86 -44.84 86.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.276 -0.874 . . . . 10.0 111.314 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.91 -52.16 53.88 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.284 -0.484 . . . . 10.0 112.477 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.426 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 93.0 t -63.34 -45.06 99.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 110.332 -0.247 . . . . 10.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.464 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 24.1 tp -56.19 -52.15 65.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.761 HD11 ' CE2' ' A' ' 62' ' ' PHE . 20.9 mt -62.54 -44.91 95.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.417 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.1 tttm -53.1 -52.02 59.97 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 123.567 0.542 . . . . 10.0 110.818 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 44.8 mm-40 -66.54 -51.99 50.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.428 -0.806 . . . . 10.0 111.212 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 74.2 mt -56.12 -48.32 76.43 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.184 0.439 . . . . 10.0 112.184 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.28 -39.05 96.66 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.344 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -71.23 -20.72 62.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.032 0.444 . . . . 10.0 111.117 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.691 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.7 mmtt -77.41 -26.68 51.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.601 -0.272 . . . . 10.0 110.796 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.528 HD11 ' HB3' ' B' ' 66' ' ' LEU . 24.5 mt -82.96 -19.2 37.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.996 -0.281 . . . . 10.0 111.297 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.385 -0.817 . . . . 10.0 110.887 -179.605 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.2 mmt . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.712 0.291 . . . . 10.0 110.336 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.53 168.52 11.2 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.424 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 28.9 t70 -68.85 -46.7 67.82 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.424 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 39.5 mmtm -137.19 107.7 6.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.176 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.769 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 31.1 tp -79.89 141.07 36.45 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.7 tppt? -77.35 130.17 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.249 0.547 . . . . 10.0 110.738 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.625 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 12.5 p90 -150.94 173.36 14.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.699 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.55 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.4 tp10 -154.72 122.79 5.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.617 ' HA ' HG12 ' B' ' 30' ' ' VAL . 52.9 mt -78.77 108.88 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.133 0.492 . . . . 10.0 110.784 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -78.87 -47.64 22.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.039 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -167.59 130.55 1.66 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.112 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -75.22 145.77 41.72 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 81.2 mt -112.0 -74.66 0.63 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.477 -0.489 . . . . 10.0 111.902 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.628 HD12 ' CB ' ' A' ' 68' ' ' GLU . 16.0 mm -127.24 140.8 48.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.025 0.44 . . . . 10.0 111.903 -177.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.413 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -125.93 122.48 62.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.078 -1.082 . . . . 10.0 108.078 177.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' A' ' 61' ' ' GLU . 28.8 mt -92.06 -81.29 0.34 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.373 -0.531 . . . . 10.0 111.778 -178.112 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -179.18 -167.71 0.11 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.484 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.15 147.55 31.12 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.348 -0.242 . . . . 10.0 110.348 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -85.15 -172.15 4.02 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.34 -20.82 66.19 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.472 0.654 . . . . 10.0 110.464 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -90.21 -2.55 58.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.177 -0.92 . . . . 10.0 110.323 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 4.52 80.85 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.484 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.7 m0 -62.33 105.99 0.69 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.748 0.308 . . . . 10.0 111.333 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.483 ' O ' ' HA ' ' B' ' 43' ' ' THR . 12.3 tpp85 -85.21 100.31 11.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.593 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.508 ' HG2' HG22 ' B' ' 43' ' ' THR . 93.9 mttt -82.06 115.73 21.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.735 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.413 ' HG2' HG23 ' B' ' 15' ' ' VAL . 90.6 mt-10 -134.23 146.61 50.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.859 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.56 HD13 ' HB ' ' B' ' 41' ' ' ILE . 42.7 tp -115.92 111.86 21.03 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.668 -0.864 . . . . 10.0 108.668 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -132.34 162.29 31.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.126 0.488 . . . . 10.0 111.623 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.1 ttm180 -97.7 113.91 25.77 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.617 HG12 ' HA ' ' B' ' 9' ' ' ILE . 22.8 m -131.55 157.12 43.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.904 0.383 . . . . 10.0 111.297 -178.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.55 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -94.19 125.3 38.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.194 178.785 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -63.88 109.2 1.68 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.543 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.5 m-80 58.5 32.91 22.65 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.831 0.707 . . . . 10.0 110.368 -178.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 67.63 17.79 9.9 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.946 -1.025 . . . . 10.0 111.414 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.04 -89.77 0.38 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.13 0.419 . . . . 10.0 112.13 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -90.96 123.32 65.06 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 112.271 0.471 . . . . 10.0 112.271 -177.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.541 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.87 126.75 8.98 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.831 2.354 . . . . 10.0 111.701 178.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -147.07 170.78 16.43 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -96.94 129.22 44.43 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.325 -0.25 . . . . 10.0 110.325 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.419 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.56 132.25 28.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.279 -0.638 . . . . 10.0 109.279 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.56 ' HB ' HD13 ' B' ' 27' ' ' LEU . 13.2 tt -106.82 122.7 61.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.324 0.583 . . . . 10.0 110.16 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.616 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.0 mtt85 -145.6 176.8 9.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.002 -0.544 . . . . 10.0 111.257 -178.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.508 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -123.85 142.92 50.68 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.332 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 m95 -117.15 173.37 6.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.103 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.0 m -67.87 157.79 85.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -55.44 -31.44 77.87 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.504 2.136 . . . . 10.0 112.48 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -99.3 6.08 46.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.464 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.48 28.39 15.42 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.102 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.58 -38.45 40.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.725 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -133.41 174.23 10.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.112 0.482 . . . . 10.0 111.128 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.411 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -136.4 172.22 13.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.165 -0.925 . . . . 10.0 111.199 -177.337 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.699 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.88 -161.25 8.67 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.984 -0.627 . . . . 10.0 111.797 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -97.79 153.16 18.47 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 122.17 -0.606 . . . . 10.0 112.485 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.61 -124.26 1.46 Allowed Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.403 -1.079 . . . . 10.0 110.403 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -153.16 143.25 14.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 117.549 0.675 . . . . 10.0 111.219 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.5 143.78 31.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.383 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 63.7 mt -123.19 129.08 50.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.08 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.0 m -74.59 163.09 28.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.79 -44.86 93.74 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 -178.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.485 ' O ' HG23 ' B' ' 64' ' ' VAL . 10.1 pt-20 -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.133 0.492 . . . . 10.0 110.465 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.143 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.532 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -58.01 -41.36 82.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.544 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.53 -52.84 50.52 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.06 -0.59 . . . . 10.0 112.059 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.489 ' HB ' HD22 ' A' ' 16' ' ' LEU . 28.0 t -63.96 -45.0 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 10.0 110.139 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.8 tp -55.72 -51.43 67.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.012 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 65.4 mt -61.19 -48.92 79.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.976 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 46.6 tttm -52.58 -52.54 54.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.549 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.76 ' HB3' HD12 ' A' ' 14' ' ' ILE . 51.2 mm-40 -65.94 -53.18 42.47 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.558 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.538 ' HB3' HD22 ' A' ' 66' ' ' LEU . 61.3 mt -57.96 -44.06 86.8 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.158 0.429 . . . . 10.0 112.158 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.2 -41.04 99.36 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 111.191 -0.764 . . . . 10.0 111.191 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -72.24 -22.5 61.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.314 -0.443 . . . . 10.0 111.565 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.634 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.6 mmtt -72.41 -26.55 61.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.576 HD11 ' CB ' ' A' ' 66' ' ' LEU . 22.5 mt -88.3 -5.88 58.08 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.151 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.453 -0.784 . . . . 10.0 109.884 179.716 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.434 -0.387 0 C3'-C2'-C1' 101.814 -0.633 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . 0.457 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 C3'-C2'-C1' 101.519 -0.843 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . 0.477 " H1'" ' O ' ' A' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.407 -1.007 0 O4'-C1'-C2' 104.05 -1.864 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.735 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 O4'-C4'-C3' 103.464 -2.136 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.431 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 O4'-C4'-C3' 103.523 -2.077 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.837 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.885 0 C5'-C4'-O4' 113.078 2.299 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 101.141 -1.113 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 C3'-C2'-C1' 101.64 -0.757 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 101.892 -0.577 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.421 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 O4'-C1'-C2' 104.393 -1.551 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.769 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C4'-C3' 103.455 -2.145 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.406 ' C6 ' HD21 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 O4'-C4'-C3' 103.737 -1.863 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.851 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.434 1.046 0 C5'-C4'-O4' 112.916 2.198 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.988 0 C3'-C2'-C1' 101.06 -1.171 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.223 0 CA-C-O 120.69 0.281 . . . . 10.0 110.619 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.12 164.32 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.148 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.6 -48.05 42.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.225 0.536 . . . . 10.0 109.762 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.414 ' HA ' ' HD2' ' A' ' 4' ' ' LYS . 12.8 mmmm -139.48 95.19 2.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.305 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.77 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 22.4 tp -68.93 146.33 52.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.439 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 35.3 tptt -79.37 134.83 36.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.652 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.4 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 6.8 p90 -161.87 166.73 25.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.222 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.494 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -151.8 133.07 14.49 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.635 -0.505 . . . . 10.0 109.635 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.421 ' HA ' HG12 ' A' ' 30' ' ' VAL . 72.4 mt -79.85 111.24 16.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.601 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -82.12 -45.81 19.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.056 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -164.73 127.5 2.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.839 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -80.05 142.07 35.27 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.486 ' O ' HD13 ' A' ' 14' ' ' ILE . 48.5 mt -112.12 -73.74 0.66 Allowed 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.409 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.686 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.0 mm -130.23 138.2 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.71 118.3 56.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 107.403 -1.332 . . . . 10.0 107.403 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.467 HD22 ' HB ' ' B' ' 64' ' ' VAL . 28.1 mt -85.81 -82.12 0.2 Allowed 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.138 -0.625 . . . . 10.0 111.808 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.2 m -174.97 -166.34 0.23 Allowed 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.538 -0.541 . . . . 10.0 109.538 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.4 mp0 -109.78 143.15 40.01 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.89 -0.411 . . . . 10.0 109.89 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -81.69 -171.82 3.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.79 -27.93 69.52 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.492 0.663 . . . . 10.0 110.391 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -87.55 3.2 48.43 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.031 -0.986 . . . . 10.0 111.0 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.11 6.27 88.32 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.545 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.434 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -61.9 103.71 0.38 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 10.0 111.416 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.9 tpp85 -81.26 99.53 8.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.185 178.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.486 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.0 mttt -83.96 121.04 26.84 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.957 0.408 . . . . 10.0 110.762 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -136.12 153.34 51.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.944 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.51 HD13 ' HB ' ' A' ' 41' ' ' ILE . 42.6 tp -123.02 106.96 11.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.918 . . . . 10.0 108.646 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -136.58 156.49 48.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.176 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -95.69 114.58 26.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.421 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.4 m -121.86 161.97 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.469 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.494 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -94.39 123.86 38.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.01 0.433 . . . . 10.0 110.43 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.97 108.41 1.49 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.619 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.441 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.7 m-80 60.81 27.4 17.2 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.003 -178.002 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.6 t70 68.62 19.57 8.57 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.938 -1.028 . . . . 10.0 110.914 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.92 -80.09 0.57 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.97 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.68 118.76 69.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -178.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.9 Cg_endo -77.95 120.3 5.0 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.621 2.214 . . . . 10.0 110.711 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.719 ' HE3' HG21 ' A' ' 56' ' ' THR . 17.3 ttpt -145.8 162.97 36.44 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.867 -0.333 . . . . 10.0 110.788 -177.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -86.57 128.32 34.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.558 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.424 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -143.03 131.46 22.24 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.51 ' HB ' HD13 ' A' ' 27' ' ' LEU . 17.9 tt -107.2 123.29 62.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.178 0.513 . . . . 10.0 110.099 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.647 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.1 mtt85 -145.32 177.6 8.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.458 -178.138 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.486 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -124.96 143.95 50.62 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.726 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 m95 -117.71 173.8 6.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.142 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 p -76.64 156.18 83.07 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.23 -27.62 85.49 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.726 2.284 . . . . 10.0 112.715 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -97.37 -4.58 38.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.651 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.29 34.01 16.17 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.45 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -83.93 -39.36 19.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.762 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -140.56 173.74 11.2 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.21 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.434 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -135.55 172.78 12.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.943 -177.931 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.689 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -137.32 -164.88 10.22 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 121.001 -0.619 . . . . 10.0 112.499 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.5 mttp -95.01 151.92 18.76 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.113 -0.639 . . . . 10.0 112.375 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.78 -128.43 1.89 Allowed Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.277 -0.874 . . . . 10.0 111.479 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -147.34 145.82 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 CA-C-N 117.727 0.764 . . . . 10.0 111.233 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.719 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.2 m -104.96 144.4 31.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.382 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.8 mt -122.43 135.16 54.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.771 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.4 m -77.46 164.51 25.37 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.127 -0.324 . . . . 10.0 110.127 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -59.39 -48.63 80.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.663 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.25 -43.57 97.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.965 0.412 . . . . 10.0 110.804 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -59.14 -48.89 79.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.246 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.651 ' CE2' HD11 ' A' ' 66' ' ' LEU . 33.5 t80 -58.06 -42.15 84.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.006 -0.997 . . . . 10.0 111.167 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.75 34.4 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.277 -0.487 . . . . 10.0 112.489 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 71.5 t -60.38 -43.7 94.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-O 120.969 0.414 . . . . 10.0 110.165 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.465 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -56.48 -52.85 63.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.542 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.691 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.5 mt -62.12 -45.67 92.43 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -52.37 -52.42 53.64 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.431 0.457 . . . . 10.0 111.19 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.576 ' CB ' HD12 ' B' ' 14' ' ' ILE . 52.1 mm-40 -68.69 -48.39 64.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.433 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.2 mt -58.97 -45.09 91.41 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.672 0.249 . . . . 10.0 111.672 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.76 -37.18 94.32 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.688 -0.767 . . . . 10.0 111.575 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -71.92 -30.06 64.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.82 0.343 . . . . 10.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 44.9 mmtt -64.63 -27.91 69.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.01 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' B' ' 66' ' ' LEU . 23.3 mt -88.75 -2.13 58.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 10.0 111.78 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.651 -179.592 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.801 0.334 . . . . 10.0 110.667 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.78 167.22 10.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.598 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -76.39 -47.94 21.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -139.46 99.2 3.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.231 -0.895 . . . . 10.0 110.102 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.748 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 26.5 tp -72.88 142.04 47.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.12 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.424 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 10.3 tppt? -77.15 134.39 38.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.948 0.404 . . . . 10.0 110.215 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.571 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 7.9 p90 -160.81 165.17 30.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.897 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.462 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.3 tp10 -149.24 131.96 15.95 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.401 ' HA ' HG12 ' B' ' 30' ' ' VAL . 61.2 mt -77.39 112.95 15.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.08 0.467 . . . . 10.0 110.147 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.0 mm -84.45 -42.8 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.096 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -168.35 127.99 1.22 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.644 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -81.41 140.13 34.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 55.7 mt -111.36 -67.19 1.01 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.496 -0.482 . . . . 10.0 112.244 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.576 HD12 ' CB ' ' A' ' 68' ' ' GLU . 12.0 mm -133.97 136.51 53.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 10.0 111.86 -177.14 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 p -120.74 120.04 61.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.233 -1.395 . . . . 10.0 107.233 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -87.04 -81.86 0.22 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.369 -0.532 . . . . 10.0 111.967 -177.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 5.4 m -177.26 -167.75 0.17 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.117 -0.697 . . . . 10.0 109.117 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.411 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 4.3 mp0 -107.07 143.48 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -82.79 -172.63 4.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.06 -25.38 68.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.31 0.576 . . . . 10.0 110.817 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -90.1 2.04 55.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.493 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.1 6.96 84.12 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.493 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.411 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.4 m0 -62.64 103.54 0.43 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.605 0.24 . . . . 10.0 111.613 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -80.35 99.98 8.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.514 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.3 mttt -84.23 119.81 25.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 10.0 110.754 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -135.5 151.59 50.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.991 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.489 HD13 ' HB ' ' B' ' 41' ' ' ILE . 39.2 tp -121.62 107.24 12.15 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -136.63 155.5 49.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.283 -178.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -94.81 115.0 26.96 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.8 m -122.26 161.68 22.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.46 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.462 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.4 p -94.34 123.49 37.78 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.273 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -63.53 109.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.448 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.424 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.4 m-80 59.06 30.9 20.82 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 123.734 0.646 . . . . 10.0 109.785 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 63.94 26.27 14.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.924 -1.035 . . . . 10.0 111.159 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.24 -78.17 0.58 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.729 -0.388 . . . . 10.0 111.755 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -88.75 117.02 67.88 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.413 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 47.9 Cg_endo -77.93 120.06 4.93 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.292 1.995 . . . . 10.0 110.481 178.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.693 ' HE3' HG21 ' B' ' 56' ' ' THR . 16.8 ttpt -146.08 164.0 33.51 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.895 -0.322 . . . . 10.0 110.442 -178.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -88.11 128.45 35.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.505 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -142.94 131.91 22.94 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.379 -0.601 . . . . 10.0 109.379 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.489 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.1 tt -107.03 123.22 62.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 121.514 0.673 . . . . 10.0 110.289 -179.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.643 HH21 H2'' ' C' ' 14' ' ' ' DT' . 4.1 mtt85 -145.54 177.55 8.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.394 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.514 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.47 144.49 50.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.854 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 42.0 m95 -118.06 174.03 6.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.312 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -77.3 156.65 81.38 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -30.01 87.3 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.652 2.234 . . . . 10.0 112.704 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -98.16 -2.94 38.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.934 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.03 31.38 13.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.545 -179.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -79.63 -39.18 32.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.967 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.19 174.05 10.96 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.36 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.406 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -136.02 172.99 12.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 10.0 110.927 -178.147 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.679 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -136.47 -163.08 9.71 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.113 -0.565 . . . . 10.0 112.273 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -97.4 149.01 22.6 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.033 -0.686 . . . . 10.0 112.33 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.405 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -141.45 -129.11 2.43 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.342 -0.845 . . . . 10.0 111.003 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -147.82 146.68 17.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.343 0.572 . . . . 10.0 110.397 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.693 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.1 m -104.38 145.36 30.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.58 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.5 mt -123.09 133.72 54.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.691 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -76.58 164.25 26.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.11 -46.92 88.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.829 0.307 . . . . 10.0 111.829 -178.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.517 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.0 pt-20 -65.46 -41.57 93.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -61.15 -49.25 77.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.156 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.96 -39.02 80.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.629 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.18 -52.24 53.17 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.934 -0.65 . . . . 10.0 112.287 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 60' ' ' GLU . 12.1 t -63.37 -44.71 99.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 10.0 110.05 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 15.7 tp -54.87 -52.36 63.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.816 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 73' ' ' LEU . 77.9 mt -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.989 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -49.89 -53.93 22.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.642 -0.708 . . . . 10.0 111.871 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.686 ' HB3' HD12 ' A' ' 14' ' ' ILE . 13.8 mm-40 -68.84 -47.89 64.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.97 -0.559 . . . . 10.0 112.093 -178.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.691 ' HB3' HD22 ' A' ' 66' ' ' LEU . 69.0 mt -61.65 -43.53 98.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.746 0.308 . . . . 10.0 111.696 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -35.65 92.34 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.517 -0.633 . . . . 10.0 111.517 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' ASN . . . . . 0.435 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 21.1 t-20 -74.55 -27.63 60.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 10.0 110.872 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.5 mmtt -65.55 -29.04 69.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.837 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.0 mt -90.71 6.64 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.965 -0.294 . . . . 10.0 111.655 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.435 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.2 mt-10 . . . . . 0 C--O 1.245 0.829 0 CA-C-O 118.197 -0.906 . . . . 10.0 110.525 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 C3'-C2'-C1' 101.666 -0.738 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 C5'-C4'-C3' 115.887 0.792 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -0.971 0 O4'-C1'-C2' 104.233 -1.697 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.77 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O4'--C1' 1.429 0.687 0 O4'-C4'-C3' 103.459 -2.141 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.544 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.887 0 O4'-C4'-C3' 103.461 -2.139 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.893 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.934 0 C5'-C4'-O4' 113.078 2.299 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C3'-C2'-C1' 101.153 -1.105 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 C3'-C2'-C1' 101.386 -0.938 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.909 0 C3'-C2'-C1' 101.629 -0.765 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 O4'-C1'-C2' 104.37 -1.573 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.748 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C4'-C3' 103.574 -2.026 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.67 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 O4'-C4'-C3' 103.771 -1.829 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.856 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.819 0 C5'-C4'-O4' 113.144 2.34 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.862 0 C3'-C2'-C1' 101.258 -1.03 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.15 155.44 17.74 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.58 -55.29 24.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 10.0 109.815 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -132.35 93.89 3.34 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.335 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.644 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 20.2 tp -65.81 150.79 48.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.355 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 15.4 tppt? -77.63 133.25 38.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.636 0.255 . . . . 10.0 110.455 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -159.14 167.95 27.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.535 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -154.11 129.48 9.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.401 ' HA ' HG12 ' A' ' 30' ' ' VAL . 49.1 mt -79.13 112.58 17.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.142 0.496 . . . . 10.0 110.704 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -79.42 -40.18 21.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.653 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -169.02 141.91 2.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.247 -0.888 . . . . 10.0 110.347 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.89 135.95 33.17 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.615 -0.883 . . . . 10.0 108.615 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 91.2 mt -104.24 -75.29 0.62 Allowed 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.573 -0.451 . . . . 10.0 111.375 -179.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.714 HD12 ' HB3' ' B' ' 68' ' ' GLU . 32.6 mm -131.68 139.22 51.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 10.0 112.074 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.9 p -122.63 125.79 73.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 107.622 -1.251 . . . . 10.0 107.622 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.481 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -93.89 -81.05 0.38 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.214 -0.595 . . . . 10.0 111.813 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.5 m -177.76 -169.78 0.23 Allowed 'General case' 0 C--O 1.237 0.4 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 -179.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.0 mp0 -104.27 140.62 37.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.374 . . . . 10.0 110.001 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -80.61 -172.0 3.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.61 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.2 -26.47 68.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.716 0.77 . . . . 10.0 110.855 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -91.65 3.93 53.89 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.736 -1.12 . . . . 10.0 111.243 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.23 5.89 89.25 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.518 -0.849 . . . . 10.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -62.95 104.05 0.51 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.928 0.394 . . . . 10.0 110.919 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.498 ' O ' ' HA ' ' A' ' 43' ' ' THR . 10.5 tpp85 -81.69 99.74 9.08 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.668 -0.696 . . . . 10.0 109.473 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.3 mttt -82.43 117.28 22.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.947 0.403 . . . . 10.0 110.713 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -131.53 148.88 52.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.165 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.558 HD13 ' HB ' ' A' ' 41' ' ' ILE . 43.2 tp -119.06 107.77 13.91 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 178.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -135.11 163.03 30.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.931 0.396 . . . . 10.0 110.746 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -98.66 114.85 27.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 9' ' ' ILE . 18.9 m -125.64 157.87 34.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 10.0 111.01 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.535 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 3.3 p -94.71 123.64 38.27 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.098 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -64.25 110.04 2.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.638 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.8 m-80 60.53 29.38 18.97 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 123.796 0.685 . . . . 10.0 110.452 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 61.83 34.37 17.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 114.692 -1.14 . . . . 10.0 110.594 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.5 -77.43 0.59 Allowed 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.26 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -88.66 115.24 62.89 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.667 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.1 Cg_endo -78.26 121.01 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.517 2.145 . . . . 10.0 111.292 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.486 ' NZ ' " H2'" ' C' ' 7' ' ' ' DT' . 17.0 ttpt -149.73 163.38 38.11 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.948 -0.301 . . . . 10.0 110.698 -178.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -85.51 135.29 33.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -148.84 132.1 16.47 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.558 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.9 tt -107.21 122.11 60.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.325 0.583 . . . . 10.0 109.945 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.483 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.4 mtt85 -143.83 179.36 7.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.209 -177.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.498 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -125.9 145.18 50.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.027 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.5 m95 -117.48 173.85 6.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.214 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.5 p -78.76 159.34 74.14 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -59.47 -27.22 84.41 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.354 2.036 . . . . 10.0 112.422 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -96.11 -0.86 49.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.249 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 55.7 34.89 24.23 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.752 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -92.55 -39.8 11.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.753 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -131.58 174.29 10.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.693 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.424 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -153.4 173.1 16.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.032 -177.674 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.65 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -132.77 -159.56 9.25 Favored Glycine 0 C--O 1.226 -0.38 0 C-N-CA 120.941 -0.647 . . . . 10.0 111.977 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -93.65 161.33 14.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.272 0.536 . . . . 10.0 112.3 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.96 -127.28 1.3 Allowed Glycine 0 CA--C 1.519 0.333 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.974 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -147.88 143.27 19.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 117.838 0.819 . . . . 10.0 111.269 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.47 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.1 m -100.85 145.92 27.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.231 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.1 mt -125.41 127.1 46.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.849 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -76.37 163.02 27.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.008 -0.367 . . . . 10.0 110.008 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -55.9 -50.67 70.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.934 0.346 . . . . 10.0 111.934 -178.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -61.61 -46.37 90.13 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.789 0.328 . . . . 10.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -60.27 -47.82 84.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.114 0.483 . . . . 10.0 110.476 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.666 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.2 t80 -59.43 -46.82 87.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.282 -0.872 . . . . 10.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.75 -53.29 46.4 Favored Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 116.178 -0.464 . . . . 10.0 112.578 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.492 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 88.6 t -61.21 -45.55 98.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.674 0.273 . . . . 10.0 110.28 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.55 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 23.2 tp -54.66 -53.05 59.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.669 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.666 HD11 ' CE2' ' A' ' 62' ' ' PHE . 18.4 mt -62.62 -44.45 96.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.323 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -51.98 -50.35 61.45 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.063 0.459 . . . . 10.0 110.943 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.612 ' CB ' HD12 ' B' ' 14' ' ' ILE . 56.7 mm-40 -68.13 -49.53 60.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.146 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 91.1 mt -58.27 -43.86 88.16 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.662 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.09 96.5 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.335 -0.706 . . . . 10.0 111.335 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -73.08 -28.59 62.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.625 0.25 . . . . 10.0 110.72 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 70.1 mmtt -66.67 -28.0 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.644 -0.253 . . . . 10.0 111.467 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' B' ' 66' ' ' LEU . 23.1 mt -85.8 -16.24 39.41 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.096 -0.242 . . . . 10.0 111.54 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.486 -0.769 . . . . 10.0 110.715 -179.194 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 120.796 0.332 . . . . 10.0 110.169 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.41 154.55 18.97 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.04 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.431 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 19.0 t70 -62.53 -56.07 21.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.361 0.601 . . . . 10.0 109.711 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 13.3 mmmm -131.96 95.01 3.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.256 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.741 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 20.9 tp -65.77 149.5 50.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.598 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -76.51 132.99 39.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.405 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.552 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.6 p90 -160.09 167.5 27.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.464 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.7 tp10 -153.07 129.18 10.4 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.455 ' HA ' HG12 ' B' ' 30' ' ' VAL . 68.7 mt -78.03 111.24 14.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.348 0.594 . . . . 10.0 110.555 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 mm -78.77 -41.52 24.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.776 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -169.14 139.21 2.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.34 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.74 141.45 30.53 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 83.5 mt -111.02 -70.46 0.81 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.139 -0.624 . . . . 10.0 111.617 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.612 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.3 mm -132.86 139.61 49.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.061 0.458 . . . . 10.0 111.582 -177.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.416 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.7 p -124.62 123.61 66.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 107.807 -1.182 . . . . 10.0 107.807 177.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 41.4 mt -92.73 -81.85 0.34 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.391 -0.524 . . . . 10.0 111.803 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.34 -170.45 0.22 Allowed 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 -179.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -102.84 139.39 38.47 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -79.08 -171.46 2.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.84 -17.82 65.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.431 0.634 . . . . 10.0 111.055 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -99.3 5.87 46.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.76 3.51 90.47 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.529 -0.843 . . . . 10.0 111.181 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -61.78 104.11 0.41 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.885 0.374 . . . . 10.0 111.039 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.7 tpp85 -82.82 100.0 10.05 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.621 179.121 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.53 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.6 mttt -82.11 117.47 22.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.899 0.381 . . . . 10.0 110.758 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.416 ' HG2' HG23 ' B' ' 15' ' ' VAL . 58.3 mt-10 -131.67 146.78 52.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.08 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.562 HD13 ' HB ' ' B' ' 41' ' ' ILE . 44.3 tp -117.56 107.16 13.93 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -135.22 161.81 34.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.498 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -99.43 115.05 28.37 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.455 HG12 ' HA ' ' B' ' 9' ' ' ILE . 23.0 m -124.63 159.37 30.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.76 -178.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.464 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.4 p -95.8 124.01 39.63 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.306 179.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -63.84 112.64 2.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.678 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 58.63 29.46 18.55 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.472 -177.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 62.94 32.96 15.35 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.068 -0.969 . . . . 10.0 111.099 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.06 -70.7 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.95 0.352 . . . . 10.0 111.95 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -92.46 113.59 59.84 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.738 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.07 119.95 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.393 2.062 . . . . 10.0 110.753 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.559 ' HE3' HG21 ' B' ' 56' ' ' THR . 19.4 ttpt -148.9 163.9 36.08 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.709 0.29 . . . . 10.0 110.37 -178.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -87.63 135.57 33.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.922 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -149.13 132.22 16.3 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.562 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.9 tt -106.84 123.58 61.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.206 0.527 . . . . 10.0 109.855 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.554 HH21 H2'' ' C' ' 14' ' ' ' DT' . 2.7 mtt85 -144.56 179.78 7.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.234 -177.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.53 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -126.23 144.87 50.62 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.037 -0.528 . . . . 10.0 109.954 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 36.4 m95 -117.8 174.52 6.13 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.039 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -79.08 160.08 71.84 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.713 -0.477 . . . . 10.0 109.713 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.63 -27.23 84.45 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.193 1.929 . . . . 10.0 112.103 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -95.78 -4.33 44.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.272 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.06 31.81 20.76 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.117 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -89.18 -39.77 13.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.982 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -131.63 173.17 11.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.872 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.421 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -150.95 172.45 15.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.772 -177.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.573 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -132.21 -159.72 9.42 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.318 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -93.65 156.97 16.4 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.083 -0.657 . . . . 10.0 112.262 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.62 -128.41 1.91 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.766 -0.934 . . . . 10.0 110.766 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -146.84 143.47 20.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 117.618 0.709 . . . . 10.0 110.796 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.559 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.1 m -100.83 144.52 29.68 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.771 -0.649 . . . . 10.0 111.642 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -123.62 127.29 48.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.051 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -77.03 165.98 23.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.142 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -59.82 -47.69 84.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.53 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.0 pt-20 -65.65 -43.74 88.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.897 0.38 . . . . 10.0 110.866 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 73.0 mt-10 -62.41 -47.37 84.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.414 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.42 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.0 t80 -61.96 -41.36 97.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.727 -0.67 . . . . 10.0 110.612 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.59 -53.28 47.33 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.197 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.53 HG23 ' O ' ' B' ' 60' ' ' GLU . 23.3 t -61.33 -47.47 93.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 10.0 110.216 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.5 tp -53.62 -51.62 62.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.889 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.463 ' HB3' HD11 ' A' ' 73' ' ' LEU . 56.6 mt -61.07 -48.61 80.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.139 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -52.05 -51.21 59.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.463 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.714 ' HB3' HD12 ' A' ' 14' ' ' ILE . 58.9 mm-40 -66.57 -50.73 62.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.67 -0.695 . . . . 10.0 111.582 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.658 ' HB3' HD22 ' A' ' 66' ' ' LEU . 95.6 mt -60.58 -40.74 92.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.952 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.54 -40.81 99.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.51 -0.853 . . . . 10.0 111.092 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -72.0 -28.68 63.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.644 0.259 . . . . 10.0 111.215 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -66.01 -26.45 67.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.593 0.22 . . . . 10.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.585 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.0 mt -90.07 -10.27 45.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.944 -0.303 . . . . 10.0 111.514 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.425 -0.798 . . . . 10.0 109.89 179.712 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.513 -0.55 0 C3'-C2'-C1' 101.628 -0.766 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . 0.468 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 C3'-C2'-C1' 101.383 -0.941 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . 0.468 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.885 0 O4'-C1'-C2' 104.132 -1.789 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.681 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 O4'-C4'-C3' 103.481 -2.119 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.483 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.796 0 O4'-C4'-C3' 103.452 -2.148 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.863 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.52 -0.797 0 C5'-C4'-O4' 113.203 2.377 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . 0.486 " H2'" ' NZ ' ' A' ' 38' ' ' LYS . . . . . . . . 0 O5'--C5' 1.425 -0.951 0 C3'-C2'-C1' 101.306 -0.996 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.867 0 C3'-C2'-C1' 101.51 -0.85 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . 0.43 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 C3'-C2'-C1' 101.877 -0.588 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.43 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.862 0 O4'-C1'-C2' 104.353 -1.589 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.741 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 O4'-C4'-C3' 103.555 -2.045 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.498 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.425 -0.927 0 O4'-C4'-C3' 103.631 -1.969 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.875 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.737 0 C5'-C4'-O4' 113.026 2.266 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.996 0 C3'-C2'-C1' 101.195 -1.075 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 121.003 0.43 . . . . 10.0 110.564 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.44 172.67 7.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.024 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -74.7 -51.8 13.31 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.742 -0.466 . . . . 10.0 109.742 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.53 94.05 3.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.946 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.741 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 25.5 tp -65.17 144.47 57.18 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.401 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 14.7 tppt? -78.1 130.84 36.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.932 0.396 . . . . 10.0 110.471 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.604 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 11.3 p90 -157.0 172.33 18.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.644 179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.402 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.5 tp10 -154.88 134.76 12.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.417 ' HA ' HG12 ' A' ' 30' ' ' VAL . 56.4 mt -82.87 111.65 19.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 10.0 110.56 -179.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.12 -47.66 19.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.507 -0.769 . . . . 10.0 110.201 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -160.99 130.82 4.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.001 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.61 129.07 35.14 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.555 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 55.8 mt -98.95 -75.66 0.55 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.285 -0.566 . . . . 10.0 111.632 -178.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.662 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.8 mm -134.39 141.11 44.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.992 0.425 . . . . 10.0 112.029 -177.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.1 p -121.8 122.67 67.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.087 -1.079 . . . . 10.0 108.087 177.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.589 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -90.78 -80.65 0.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.303 -0.559 . . . . 10.0 111.882 -177.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -175.17 -167.62 0.28 Allowed 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.475 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 3.5 mp0 -115.84 134.77 54.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.792 0.33 . . . . 10.0 110.338 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -73.12 -174.2 1.49 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.15 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.51 -26.12 68.56 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 121.553 0.692 . . . . 10.0 110.418 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.414 ' HG2' ' C2 ' ' C' ' 1' ' ' ' DT' . 23.0 mttt -85.24 -2.04 57.61 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.0 -1.0 . . . . 10.0 110.868 -179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.75 6.19 83.12 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.76 -0.936 . . . . 10.0 110.76 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.475 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.3 m0 -62.01 103.66 0.39 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.031 0.443 . . . . 10.0 111.513 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.551 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.6 tpp85 -80.88 99.1 8.16 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.29 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HG2' HG22 ' A' ' 43' ' ' THR . 90.8 mttt -83.2 113.26 20.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.064 0.459 . . . . 10.0 110.614 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.405 ' HG2' HG23 ' A' ' 15' ' ' VAL . 64.1 mt-10 -132.01 150.06 52.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.416 -0.811 . . . . 10.0 111.238 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.688 HD13 ' HB ' ' A' ' 41' ' ' ILE . 44.6 tp -117.85 109.34 16.43 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.664 -1.236 . . . . 10.0 107.664 178.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -134.76 156.94 47.97 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.087 0.47 . . . . 10.0 111.326 -177.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.1 ttm180 -96.85 114.55 26.19 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 10.0 108.781 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.417 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.8 m -126.73 159.98 35.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.8 0.334 . . . . 10.0 110.943 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.0 OUTLIER -95.62 122.99 38.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.316 179.125 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -64.47 111.43 2.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.897 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.2 m-80 59.47 29.07 18.59 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.816 0.698 . . . . 10.0 110.286 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.4 t0 66.72 24.42 9.97 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.468 -1.242 . . . . 10.0 111.143 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.69 -91.58 0.44 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.534 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -83.88 123.92 75.34 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.722 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.9 Cg_endo -82.29 122.59 3.72 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.025 2.483 . . . . 10.0 111.701 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -142.89 164.56 29.75 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.769 -0.373 . . . . 10.0 110.128 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -89.35 128.86 35.94 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -139.71 131.46 27.45 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.688 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.5 tt -108.0 121.28 60.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.521 0.676 . . . . 10.0 109.952 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.489 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.5 mtt85 -144.75 -178.14 5.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.069 -177.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.551 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -126.11 144.41 50.75 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.781 179.499 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -117.14 179.75 3.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.894 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 p -81.95 161.37 60.88 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 -32.19 93.68 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.292 1.995 . . . . 10.0 112.156 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.96 -5.96 54.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.403 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 62.12 36.26 15.25 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.545 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 50' ' ' LYS . 8.8 pt-20 -93.89 -40.48 10.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.857 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.404 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 43.6 mmtm -126.94 172.26 10.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.448 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.47 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -152.45 173.34 15.24 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.35 -177.762 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.546 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -134.06 -161.37 9.59 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.263 -0.97 . . . . 10.0 112.589 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -89.87 154.83 19.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.003 0.43 . . . . 10.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.429 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.35 -128.02 1.52 Allowed Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.163 -0.926 . . . . 10.0 111.156 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -143.33 143.5 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 117.755 0.777 . . . . 10.0 111.192 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.06 140.81 39.28 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.323 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.39 128.71 49.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.544 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 69.8 m -84.34 170.24 13.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.492 -0.322 . . . . 10.0 110.551 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -52.9 -51.94 59.39 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.106 0.78 . . . . 10.0 113.106 -178.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.99 -46.67 86.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.743 0.306 . . . . 10.0 111.463 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.07 -48.73 78.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.21 0.528 . . . . 10.0 110.67 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.648 ' CE2' HD11 ' A' ' 66' ' ' LEU . 32.9 t80 -61.77 -43.11 99.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.217 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.68 -52.41 53.21 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.862 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.416 ' HB ' HD22 ' B' ' 16' ' ' LEU . 58.7 t -60.62 -41.55 88.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.14 0.495 . . . . 10.0 110.083 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.7 tp -59.11 -55.25 37.42 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.422 -0.808 . . . . 10.0 110.667 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.689 HD22 ' HB3' ' B' ' 69' ' ' LEU . 16.5 mt -59.45 -47.02 87.09 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -48.86 -55.59 11.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.593 -0.73 . . . . 10.0 111.626 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.547 ' CB ' HD12 ' B' ' 14' ' ' ILE . 62.6 mm-40 -72.28 -41.99 66.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.768 -178.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.0 mt -59.66 -45.89 90.67 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.637 0.256 . . . . 10.0 111.583 -179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.06 -36.78 93.41 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.367 -0.921 . . . . 10.0 111.076 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -67.55 -25.0 65.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 10.0 110.891 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.7 mmtt -72.37 -26.88 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.447 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.484 HD11 ' HB3' ' B' ' 66' ' ' LEU . 35.2 mt -88.14 -18.74 28.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.637 0.256 . . . . 10.0 111.009 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.594 -0.717 . . . . 10.0 111.044 -179.529 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.897 0.38 . . . . 10.0 110.425 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.82 167.06 10.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.403 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 31.6 t70 -70.82 -53.98 13.29 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.403 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 20.7 mmtm -132.76 94.26 3.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.835 179.213 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.708 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 27.2 tp -65.57 142.23 58.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.808 0.337 . . . . 10.0 110.268 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.9 tppt? -75.26 126.98 32.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.58 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.671 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 10.9 p90 -153.01 171.69 17.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.914 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.531 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.7 tp10 -155.15 132.01 10.73 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.435 ' HA ' HG12 ' B' ' 30' ' ' VAL . 53.4 mt -81.22 114.46 22.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.203 0.525 . . . . 10.0 110.633 -179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.1 mm -86.42 -41.0 14.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -166.17 130.04 2.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.651 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.86 132.24 39.05 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.736 -0.838 . . . . 10.0 108.736 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 29.3 mt -102.97 -72.91 0.68 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.384 -0.526 . . . . 10.0 111.76 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.547 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.0 mm -136.66 137.94 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.918 0.389 . . . . 10.0 112.016 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 p -119.0 122.98 70.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' LEU . . . . . 0.416 HD22 ' HB ' ' A' ' 64' ' ' VAL . 38.6 mt -90.67 -80.34 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.599 -0.44 . . . . 10.0 111.433 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -177.06 -167.18 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.3 mt-10 -115.78 136.43 53.06 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.924 -0.398 . . . . 10.0 109.924 179.022 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -74.14 -175.35 2.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.214 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.83 -25.64 68.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.289 0.566 . . . . 10.0 110.751 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -86.12 0.51 53.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.52 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 6.36 85.14 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.284 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.501 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -62.5 104.31 0.5 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.971 0.415 . . . . 10.0 111.705 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.538 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.2 tpp85 -80.56 99.57 8.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.272 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.605 ' HG2' HG22 ' B' ' 43' ' ' THR . 91.5 mttt -83.2 114.09 21.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.969 0.414 . . . . 10.0 110.798 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -133.67 151.56 51.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.756 HD13 ' HB ' ' B' ' 41' ' ' ILE . 48.3 tp -119.01 109.07 15.51 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.539 -1.282 . . . . 10.0 107.539 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -133.95 156.59 47.87 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.152 0.501 . . . . 10.0 111.209 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -96.71 114.33 25.96 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' B' ' 9' ' ' ILE . 14.5 m -126.65 160.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.86 0.362 . . . . 10.0 110.86 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.531 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -96.53 123.02 40.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.371 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -64.07 111.23 2.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.903 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.421 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 66.2 m-80 60.12 29.32 18.91 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.064 -178.067 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.8 t70 69.38 16.04 8.35 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.176 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.15 -93.56 0.32 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.164 0.431 . . . . 10.0 112.164 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -80.03 122.62 83.32 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.792 0.33 . . . . 10.0 111.751 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 82.9 Cg_endo -82.16 124.38 4.3 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.894 2.396 . . . . 10.0 111.591 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -143.78 165.69 26.98 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -91.14 128.7 37.06 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t0 -139.15 130.19 26.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.756 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.2 tt -106.18 121.55 58.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 121.441 0.638 . . . . 10.0 109.934 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.521 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.1 mtt85 -144.88 -178.07 5.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.257 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.605 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.85 144.77 50.52 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.123 -0.489 . . . . 10.0 109.937 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -117.41 179.54 4.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.12 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.73 161.75 57.59 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.42 -35.28 96.19 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.312 2.008 . . . . 10.0 112.082 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -89.17 -5.47 57.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.549 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.55 37.24 16.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.898 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -94.04 -39.7 10.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.632 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -128.77 169.87 14.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.015 0.436 . . . . 10.0 110.942 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.467 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -149.68 172.83 14.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.343 -177.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.502 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -133.72 -162.83 10.19 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.959 -0.638 . . . . 10.0 112.212 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -89.11 153.45 20.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.202 0.525 . . . . 10.0 112.197 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.435 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -147.32 -128.73 1.87 Allowed Glycine 0 C--N 1.331 0.282 0 N-CA-C 110.645 -0.982 . . . . 10.0 110.645 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -143.37 141.97 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 117.665 0.733 . . . . 10.0 111.13 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.11 142.25 35.22 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.254 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -125.76 126.45 44.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.582 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.9 m -79.92 171.52 15.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.25 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -55.85 -52.51 63.78 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.301 0.482 . . . . 10.0 112.301 -178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.589 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.3 pt-20 -60.88 -44.59 96.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.787 0.327 . . . . 10.0 111.447 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -64.39 -49.59 71.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.001 0.429 . . . . 10.0 110.848 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -62.65 -39.32 93.51 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.908 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.97 -54.02 40.92 Favored Glycine 0 C--N 1.328 0.128 0 C-N-CA 121.163 -0.541 . . . . 10.0 112.961 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.589 ' HB ' HD22 ' A' ' 16' ' ' LEU . 13.0 t -61.36 -39.68 83.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.161 0.505 . . . . 10.0 109.904 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.0 tp -59.87 -55.11 38.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.278 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.484 ' HB3' HD11 ' A' ' 73' ' ' LEU . 75.5 mt -58.03 -49.47 76.74 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.212 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.7 tttm -49.14 -57.18 7.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.016 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.662 ' HB3' HD12 ' A' ' 14' ' ' ILE . 65.5 mm-40 -70.48 -42.91 70.77 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.24 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.689 ' HB3' HD22 ' A' ' 66' ' ' LEU . 49.0 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.609 0.226 . . . . 10.0 111.609 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.95 -35.66 92.29 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' ASN . . . . . 0.41 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 10.6 t-20 -70.3 -27.26 64.25 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.951 0.405 . . . . 10.0 111.143 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 52.1 mmtt -69.0 -27.11 65.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.594 -0.276 . . . . 10.0 111.59 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 66' ' ' LEU . 27.6 mt -89.91 -5.81 56.39 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.774 -0.37 . . . . 10.0 111.63 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.41 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.2 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.663 -0.684 . . . . 10.0 110.362 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . 0.414 ' C2 ' ' HG2' ' A' ' 21' ' ' LYS . . . . . . . . 0 C2'--C1' 1.514 -0.529 0 C3'-C2'-C1' 101.698 -0.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.809 0 C3'-C2'-C1' 101.53 -0.836 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.921 0 O4'-C1'-C2' 104.256 -1.676 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.741 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.521 -0.706 0 O4'-C4'-C3' 103.567 -2.033 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.489 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C4'-C3' 103.45 -2.15 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.857 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.865 0 C5'-C4'-O4' 113.119 2.325 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 101.171 -1.092 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.999 0 C3'-C2'-C1' 101.449 -0.894 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.04 0 C3'-C2'-C1' 101.923 -0.555 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.454 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.409 -0.829 0 O4'-C1'-C2' 104.38 -1.564 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.708 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.519 -0.932 0 O4'-C4'-C3' 103.52 -2.08 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.488 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.896 0 O4'-C4'-C3' 103.814 -1.786 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.853 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.531 0.746 0 C5'-C4'-O4' 113.068 2.293 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 101.142 -1.113 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.622 0.249 . . . . 10.0 110.749 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.14 150.25 25.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.519 -0.548 . . . . 10.0 109.519 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.461 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 36.8 t70 -63.35 -41.16 98.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.846 0.355 . . . . 10.0 110.574 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 21.3 mmtm -135.79 103.56 5.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.062 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.748 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.0 tp -87.31 142.2 28.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -75.28 126.32 30.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.29 0.567 . . . . 10.0 110.744 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.466 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 12.3 p90 -146.34 169.71 18.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.637 -0.711 . . . . 10.0 109.154 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.487 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.0 tp10 -153.84 122.1 6.14 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.443 ' HA ' HG12 ' A' ' 30' ' ' VAL . 64.4 mt -73.23 112.97 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.078 0.466 . . . . 10.0 110.362 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -85.16 -42.76 16.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.144 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -165.48 134.23 3.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.853 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -85.71 133.25 34.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.4 mt -102.15 -75.8 0.59 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.5 -0.48 . . . . 10.0 111.9 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.65 HD12 ' HB3' ' B' ' 68' ' ' GLU . 35.6 mm -131.74 137.27 55.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.568 0.581 . . . . 10.0 112.568 -177.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.426 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.0 p -116.31 120.68 65.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.219 -1.03 . . . . 10.0 108.219 177.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.3 mt -87.77 -81.44 0.24 Allowed 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.386 -0.526 . . . . 10.0 111.768 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m -178.29 -168.69 0.16 Allowed 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.63 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 14.8 mp0 -114.48 139.04 49.87 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.204 0.315 . . . . 10.0 110.924 179.579 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -76.1 -171.81 1.82 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.318 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.92 -26.45 68.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.311 0.577 . . . . 10.0 111.173 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.594 ' HD3' H2'' ' C' ' 1' ' ' ' DT' . 47.1 mttt -88.51 1.8 54.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.361 -0.836 . . . . 10.0 111.133 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.24 4.38 88.16 Favored Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.68 ' HB3' HG21 ' A' ' 43' ' ' THR . 37.9 m0 -57.74 107.96 0.51 Allowed 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.259 -0.47 . . . . 10.0 111.911 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.9 tpp85 -86.86 104.86 16.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.889 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.539 ' CG ' HG23 ' A' ' 43' ' ' THR . 83.3 mttt -91.68 117.41 29.72 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.277 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.426 ' HG2' HG23 ' A' ' 15' ' ' VAL . 58.2 mt-10 -135.55 147.86 48.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.466 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.755 HD13 ' HB ' ' A' ' 41' ' ' ILE . 39.4 tp -114.02 108.18 16.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.11 -0.95 . . . . 10.0 108.578 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -135.1 169.24 17.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.933 0.397 . . . . 10.0 110.832 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.446 ' HD3' ' CE1' ' A' ' 39' ' ' TYR . 10.0 ttp180 -108.86 118.01 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.9 m -127.16 161.33 34.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.724 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.487 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.8 p -96.48 123.58 40.19 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.217 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.4 109.25 1.86 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.714 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 62.1 23.96 14.2 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.301 0.572 . . . . 10.0 109.826 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t0 66.6 23.68 10.3 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.521 -1.218 . . . . 10.0 111.088 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.47 -79.64 0.52 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.901 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -98.32 125.05 44.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.583 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.0 Cg_endo -82.21 125.88 4.74 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.801 2.334 . . . . 10.0 111.66 178.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.2 ttmm -146.38 163.92 34.08 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.446 ' CE1' ' HD3' ' A' ' 29' ' ' ARG . 7.6 m-85 -84.68 129.65 34.81 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.188 -0.301 . . . . 10.0 110.188 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.465 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -143.32 127.32 17.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.755 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -105.09 123.41 59.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 CA-C-O 121.154 0.502 . . . . 10.0 109.729 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.533 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtp85 -142.91 -179.17 6.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.389 0.614 . . . . 10.0 112.27 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.68 HG21 ' HB3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -124.26 135.75 53.64 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.715 -1.129 . . . . 10.0 110.404 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -122.37 165.34 16.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.721 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -67.98 152.53 96.34 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.121 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.19 -35.88 95.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.85 2.367 . . . . 10.0 113.109 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.48 -4.92 59.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.949 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 63.0 28.94 16.43 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.833 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.419 ' H ' ' HG2' ' A' ' 49' ' ' GLU . 9.7 pt-20 -79.18 -35.41 41.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.705 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.3 mmmm -141.08 174.55 10.41 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.328 0.585 . . . . 10.0 111.63 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.527 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -135.57 168.06 19.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.888 -1.051 . . . . 10.0 110.889 -178.202 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.58 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -132.38 -171.77 12.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.056 -0.593 . . . . 10.0 112.144 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.7 mttp -90.97 151.62 21.01 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.154 -0.615 . . . . 10.0 111.838 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.07 -123.48 1.44 Allowed Glycine 0 C--N 1.333 0.398 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.6 141.07 15.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 121.366 0.603 . . . . 10.0 111.751 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.72 143.41 30.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.75 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.5 mt -119.77 128.4 53.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.378 -0.373 . . . . 10.0 110.258 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.8 m -76.16 162.93 27.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -56.64 -48.66 77.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.024 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -64.26 -43.39 95.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.004 0.431 . . . . 10.0 110.717 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.15 -51.89 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.289 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.41 -36.75 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.65 -52.49 52.16 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 121.201 -0.523 . . . . 10.0 112.032 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.1 t -64.63 -41.96 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.957 0.408 . . . . 10.0 110.075 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.447 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 13.0 tp -56.46 -52.86 63.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.443 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.872 ' HB3' HD11 ' B' ' 73' ' ' LEU . 19.0 mt -62.07 -47.04 86.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.917 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -50.48 -52.91 33.93 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.558 0.536 . . . . 10.0 111.115 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 7.5 mm-40 -70.35 -51.51 29.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.649 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.482 ' HB3' HD22 ' B' ' 66' ' ' LEU . 72.8 mt -55.37 -45.89 76.53 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -178.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.48 -39.27 97.08 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.688 -0.768 . . . . 10.0 111.34 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -72.89 -26.77 61.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.82 0.343 . . . . 10.0 110.882 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.662 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 40.5 mmtt -67.32 -30.21 69.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.548 -0.296 . . . . 10.0 110.479 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' B' ' 66' ' ' LEU . 26.0 mt -77.34 -22.2 52.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.274 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.629 -0.7 . . . . 10.0 110.389 -179.714 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.965 0.412 . . . . 10.0 110.315 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.39 150.77 23.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.22 -0.446 . . . . 10.0 109.817 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 29.0 t70 -63.79 -41.34 97.95 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.116 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.456 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 31.1 mmtm -134.35 104.82 6.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.952 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.746 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 23.7 tp -88.2 141.4 28.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 28.4 tptt -75.81 124.66 27.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.418 0.628 . . . . 10.0 110.66 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.558 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.5 p90 -144.58 168.37 20.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.22 -0.9 . . . . 10.0 108.839 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.476 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 12.7 tp10 -151.68 119.71 6.25 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.615 ' HA ' HG12 ' B' ' 30' ' ' VAL . 63.8 mt -70.86 110.79 4.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.066 0.46 . . . . 10.0 110.275 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 34.7 mm -83.44 -43.45 18.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.278 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -164.08 132.92 3.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.953 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -83.9 135.04 34.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 62.7 mt -105.51 -74.74 0.64 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.547 -0.461 . . . . 10.0 111.845 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.522 HD12 ' CB ' ' A' ' 68' ' ' GLU . 17.5 mm -130.77 137.23 56.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.434 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.5 p -117.56 118.14 57.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.168 -1.049 . . . . 10.0 108.168 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -86.68 -81.69 0.22 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.441 -0.504 . . . . 10.0 111.716 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.68 -168.83 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.835 0.454 . . . . 10.0 109.81 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.634 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 15.7 mp0 -113.59 141.53 47.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.517 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -76.98 -169.41 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.764 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.21 -20.71 64.86 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.142 0.496 . . . . 10.0 111.041 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' LYS . . . . . 0.62 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 42.4 mttt -91.51 1.32 57.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.694 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.46 3.01 84.63 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.006 -0.838 . . . . 10.0 111.006 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.681 ' HB3' HG21 ' B' ' 43' ' ' THR . 38.1 m0 -57.07 108.96 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.315 -0.443 . . . . 10.0 112.152 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.2 tpp85 -87.5 105.52 17.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.132 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.527 ' HG2' HG23 ' B' ' 43' ' ' THR . 70.2 mttt -91.82 116.47 28.93 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.945 0.402 . . . . 10.0 110.465 179.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.434 ' HG2' HG23 ' B' ' 15' ' ' VAL . 57.2 mt-10 -134.51 146.87 50.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.069 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.8 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.4 tp -113.73 108.41 17.07 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -134.89 169.1 17.9 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.856 0.36 . . . . 10.0 110.736 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.535 ' HD3' ' CE1' ' B' ' 39' ' ' TYR . 14.3 ttp180 -108.94 115.63 30.44 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.615 HG12 ' HA ' ' B' ' 9' ' ' ILE . 25.5 m -125.14 161.74 28.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.751 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.2 p -96.56 123.82 40.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.319 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.02 110.06 2.01 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.292 -0.632 . . . . 10.0 109.292 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.427 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.44 26.95 16.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.479 0.656 . . . . 10.0 110.039 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 39.2 t0 63.27 25.46 14.74 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.623 -1.171 . . . . 10.0 110.839 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -78.85 0.56 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.767 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.511 ' OE1' H2'' ' C' ' 17' ' ' ' DT' . 35.1 tt0 -99.08 122.59 51.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-O 120.697 0.284 . . . . 10.0 111.666 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.5 Cg_endo -80.14 126.97 6.56 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.922 2.414 . . . . 10.0 112.027 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.428 ' HD2' HG22 ' B' ' 56' ' ' THR . 18.1 ttmm -148.1 165.27 31.34 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' TYR . . . . . 0.535 ' CE1' ' HD3' ' B' ' 29' ' ' ARG . 7.0 m-85 -85.64 128.78 34.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.268 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 11.3 t0 -143.04 127.46 17.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.8 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.9 tt -105.47 123.28 59.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.552 HH21 H2'' ' C' ' 14' ' ' ' DT' . 4.8 mtp85 -143.12 -179.22 6.25 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.407 0.622 . . . . 10.0 112.373 -177.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.681 HG21 ' HB3' ' B' ' 23' ' ' TRP . 0.2 OUTLIER -123.73 136.72 54.61 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.263 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -122.5 166.39 14.86 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.624 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -69.69 152.52 96.14 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 10.0 109.953 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.02 -40.46 81.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.926 2.418 . . . . 10.0 113.0 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -84.98 -5.26 59.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 10.0 110.859 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 66.27 24.3 10.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.375 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -72.02 -38.93 69.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.823 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -138.5 174.55 10.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.467 0.651 . . . . 10.0 111.853 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.535 ' O ' " H1'" ' C' ' 13' ' ' ' DT' . 0.0 OUTLIER -135.49 166.98 21.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.671 -1.15 . . . . 10.0 110.631 -178.131 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.587 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -131.2 -169.28 12.39 Favored Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.126 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -92.33 146.92 23.33 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.169 -0.606 . . . . 10.0 111.914 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.404 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -141.22 -125.31 2.1 Favored Glycine 0 N--CA 1.453 -0.221 0 N-CA-C 110.7 -0.96 . . . . 10.0 110.7 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.1 tt -151.93 139.47 13.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 117.684 0.742 . . . . 10.0 111.55 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.428 HG22 ' HD2' ' B' ' 38' ' ' LYS . 0.9 OUTLIER -98.54 141.47 31.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.887 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 76.5 mt -118.45 129.32 55.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.486 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.7 m -73.67 164.58 26.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -60.08 -48.21 82.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.467 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.426 ' O ' HG23 ' B' ' 64' ' ' VAL . 14.7 pt-20 -63.53 -41.0 98.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.041 0.448 . . . . 10.0 110.739 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -63.49 -53.22 55.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.918 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.41 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.8 t80 -61.08 -36.78 80.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.291 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.51 -52.7 50.97 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.204 -0.522 . . . . 10.0 112.102 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.426 HG23 ' O ' ' B' ' 60' ' ' GLU . 60.5 t -64.02 -43.22 97.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.043 0.449 . . . . 10.0 109.887 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.52 -52.7 62.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.569 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.51 ' HB3' HD11 ' A' ' 73' ' ' LEU . 44.0 mt -60.6 -49.57 77.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.462 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -50.09 -54.07 22.97 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 123.523 0.515 . . . . 10.0 111.363 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.65 ' HB3' HD12 ' A' ' 14' ' ' ILE . 6.3 mm-40 -69.19 -52.98 22.45 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.655 -178.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.595 ' HB3' HD22 ' A' ' 66' ' ' LEU . 61.0 mt -56.36 -44.57 80.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.98 -38.62 95.79 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.972 -0.633 . . . . 10.0 111.644 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' ASN . . . . . 0.468 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.1 t-20 -75.67 -23.07 56.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.806 0.336 . . . . 10.0 111.013 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.1 mmtt -69.83 -26.07 64.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.507 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.872 HD11 ' HB3' ' A' ' 66' ' ' LEU . 22.0 mt -84.85 -12.57 53.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.974 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.468 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.9 mt-10 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.619 -0.705 . . . . 10.0 110.246 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . 0.594 H2'' ' HD3' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 O5'-C5'-C4' 109.108 -0.78 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . 0.426 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.847 0 C3'-C2'-C1' 101.22 -1.057 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . 0.527 " H1'" ' O ' ' A' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.408 -0.951 0 O4'-C1'-C2' 103.616 -2.259 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.754 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.52 -0.773 0 O4'-C4'-C3' 103.814 -1.786 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.512 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -1.002 0 O4'-C4'-C3' 103.482 -2.118 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.885 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.815 0 C5'-C4'-O4' 113.326 2.454 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 C3'-C2'-C1' 100.971 -1.235 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . 0.62 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 C3'-C2'-C1' 101.106 -1.138 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . 0.411 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.933 0 C3'-C2'-C1' 101.636 -0.76 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.535 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O5'--C5' 1.426 -0.892 0 O4'-C1'-C2' 103.952 -1.953 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.746 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.893 0 O4'-C4'-C3' 103.707 -1.893 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.533 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.422 -1.13 0 O4'-C4'-C3' 103.945 -1.655 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.872 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.905 0 C5'-C4'-O4' 113.275 2.422 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.511 H2'' ' OE1' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 C3'-C2'-C1' 100.961 -1.242 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 mmt . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.83 0.348 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.0 171.86 7.25 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.499 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 34.3 t70 -71.15 -50.61 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.9 -0.408 . . . . 10.0 109.9 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 45.8 mmtm -140.66 120.86 13.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.668 178.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.846 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.3 tp -92.87 138.74 31.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -72.03 128.71 36.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.459 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.506 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 9.5 p90 -156.11 163.17 39.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.483 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 6.7 tp10 -145.64 134.57 22.52 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.262 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.3 mt -84.3 110.36 18.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.402 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 41.2 mm -78.52 -47.62 23.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.763 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -162.32 134.62 5.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.905 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.62 137.26 37.76 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 72.2 mt -106.32 -75.94 0.62 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.157 -0.617 . . . . 10.0 111.44 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.612 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.5 mm -132.93 139.35 49.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -177.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.416 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -117.04 125.72 74.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 107.805 -1.183 . . . . 10.0 107.805 177.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.534 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.8 mt -95.66 -81.12 0.41 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.984 -0.686 . . . . 10.0 112.033 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 m -176.35 -165.18 0.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 17.9 mt-10 -117.43 143.73 45.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.855 0.36 . . . . 10.0 110.53 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -80.21 -176.68 5.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.678 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.57 -21.43 66.34 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.607 0.718 . . . . 10.0 110.711 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.438 ' HD3' H2'' ' C' ' 1' ' ' ' DT' . 43.3 mttt -87.23 -6.31 58.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.087 -0.961 . . . . 10.0 110.556 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.23 3.46 72.6 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.076 -0.81 . . . . 10.0 111.076 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.563 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.4 m0 -60.77 108.15 0.81 Allowed 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.742 -0.229 . . . . 10.0 111.345 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.8 tpp85 -84.05 100.26 10.98 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.642 ' HG2' HG22 ' A' ' 43' ' ' THR . 80.0 mttt -84.51 114.15 21.74 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.75 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.416 ' HG2' HG23 ' A' ' 15' ' ' VAL . 73.3 mt-10 -134.06 147.73 50.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.875 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.708 HD13 ' HB ' ' A' ' 41' ' ' ILE . 37.2 tp -115.34 110.56 19.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.232 -0.895 . . . . 10.0 108.623 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.57 159.31 40.84 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.051 0.453 . . . . 10.0 111.304 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -95.75 113.94 25.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.9 m -126.85 159.33 36.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.94 0.4 . . . . 10.0 110.868 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.3 p -96.8 123.72 40.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.471 179.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.5 m0 -63.62 108.64 1.44 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.489 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.3 m-80 59.61 28.93 18.45 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.107 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 63.67 26.9 14.7 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 114.927 -1.033 . . . . 10.0 111.229 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.88 -70.49 0.79 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.646 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 40.1 tt0 -95.12 112.83 59.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.573 -0.285 . . . . 10.0 111.726 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 6.3 Cg_exo -77.06 120.38 5.39 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.018 2.479 . . . . 10.0 110.909 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.577 ' HE3' HG21 ' A' ' 56' ' ' THR . 19.5 ttpt -148.89 166.55 28.23 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.733 -0.387 . . . . 10.0 110.61 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -90.26 134.48 34.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.64 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.57 132.97 18.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.708 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.9 tt -109.78 122.84 65.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 121.321 0.581 . . . . 10.0 109.802 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.449 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.2 mtt85 -144.9 179.73 7.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.197 -178.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.642 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -125.1 144.21 50.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.256 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -117.78 171.03 8.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.798 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 m -70.28 157.55 89.65 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.92 -29.22 88.91 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.248 1.965 . . . . 10.0 112.016 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -94.34 -1.07 54.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.811 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 61.78 27.01 16.47 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.127 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -76.81 -36.19 57.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.417 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -139.25 174.66 10.28 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.52 0.676 . . . . 10.0 112.304 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.416 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -136.93 172.93 12.28 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.337 -1.301 . . . . 10.0 110.302 -178.118 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.476 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -143.09 -167.38 11.53 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 120.852 -0.69 . . . . 10.0 111.969 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -93.36 147.53 22.86 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.029 -0.689 . . . . 10.0 112.241 -179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.24 -117.89 1.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.576 -1.01 . . . . 10.0 110.576 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.29 141.27 15.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 117.348 0.574 . . . . 10.0 111.031 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.577 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.2 m -101.85 141.32 34.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.595 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.5 mt -119.28 129.41 54.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.164 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 t -79.5 168.35 19.56 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.854 -0.425 . . . . 10.0 109.854 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -58.39 -50.5 73.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.075 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.18 -41.91 98.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.041 0.448 . . . . 10.0 110.886 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.19 -54.02 44.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.016 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.691 ' CE2' HD11 ' A' ' 66' ' ' LEU . 33.1 t80 -56.78 -43.16 80.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.352 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.28 -52.5 52.89 Favored Glycine 0 CA--C 1.519 0.292 0 C-N-CA 121.327 -0.463 . . . . 10.0 113.155 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.73 -42.56 95.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.861 0.362 . . . . 10.0 110.482 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.456 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.4 tp -56.25 -51.35 68.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.804 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.703 HD22 ' HB3' ' B' ' 69' ' ' LEU . 21.5 mt -62.67 -46.61 87.37 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.467 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.9 tttm -50.83 -54.46 23.58 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.705 0.628 . . . . 10.0 111.352 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.579 ' CB ' HD12 ' B' ' 14' ' ' ILE . 9.2 mm-40 -66.9 -51.23 57.93 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.801 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 81.8 mt -57.5 -45.84 84.46 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.54 -39.37 97.56 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.884 -0.674 . . . . 10.0 111.767 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -68.6 -27.47 66.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.625 0.25 . . . . 10.0 111.142 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 75.3 mmtt -69.59 -28.71 66.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.866 0.365 . . . . 10.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' B' ' 66' ' ' LEU . 32.2 mt -89.67 -2.84 58.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.323 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.656 -179.608 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 23.7 mmt . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.834 0.35 . . . . 10.0 110.144 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.31 167.55 9.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.065 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.465 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 38.0 t70 -66.79 -54.33 23.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.141 0.496 . . . . 10.0 110.026 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.465 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 42.9 mmtm -139.44 118.07 12.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.349 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.81 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 24.8 tp -89.03 138.65 31.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.662 0.268 . . . . 10.0 110.494 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.0 tppt? -72.1 128.34 35.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.591 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.552 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 7.6 p90 -156.49 163.57 39.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.141 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -147.29 136.35 22.34 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.747 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -84.54 111.76 20.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.678 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.51 -45.33 23.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.176 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -165.47 131.53 2.66 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.478 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.4 139.95 41.15 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.527 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 70.0 mt -109.92 -73.69 0.68 Allowed 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.203 -0.599 . . . . 10.0 111.936 -178.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.579 HD12 ' CB ' ' A' ' 68' ' ' GLU . 16.4 mm -132.49 138.01 53.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.42 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.5 p -117.48 122.43 69.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 49.0 mt -93.25 -81.31 0.36 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.274 -0.57 . . . . 10.0 112.32 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.4 m -176.22 -166.45 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.562 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 48.6 mt-10 -117.91 140.24 49.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.684 0.278 . . . . 10.0 110.526 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -75.83 -176.01 3.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.057 -0.519 . . . . 10.0 109.927 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.9 -16.84 64.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.416 0.627 . . . . 10.0 110.785 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' LYS . . . . . 0.455 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 47.1 mttt -91.84 -4.79 54.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.375 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.7 2.07 73.0 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.621 -0.8 . . . . 10.0 111.412 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.562 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.0 m0 -59.45 107.05 0.52 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 120.805 0.335 . . . . 10.0 111.537 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.6 tpp85 -82.96 100.2 10.27 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.655 ' HG2' HG22 ' B' ' 43' ' ' THR . 79.3 mttt -84.7 114.05 21.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.883 -179.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.42 ' HG2' HG23 ' B' ' 15' ' ' VAL . 64.8 mt-10 -135.22 147.4 49.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.681 . . . . 10.0 110.992 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.663 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.0 tp -114.4 110.76 20.38 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.258 -0.883 . . . . 10.0 108.906 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.73 158.94 42.03 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.038 0.446 . . . . 10.0 111.069 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -95.36 113.71 25.41 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 m -126.44 161.16 33.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.901 0.382 . . . . 10.0 110.778 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.479 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -98.52 124.24 43.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.565 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -64.08 108.13 1.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.573 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.403 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.07 29.5 19.06 Favored 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 123.783 0.677 . . . . 10.0 109.896 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 27.9 t70 63.19 22.11 13.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 114.615 -1.175 . . . . 10.0 111.299 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.14 -66.6 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.035 -0.415 . . . . 10.0 111.785 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.44 112.13 61.59 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.479 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 56.5 Cg_endo -77.18 120.19 5.27 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.219 1.946 . . . . 10.0 110.872 178.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.536 ' HE3' HG21 ' B' ' 56' ' ' THR . 16.9 ttpt -147.81 170.39 17.72 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.014 -0.274 . . . . 10.0 110.509 -178.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -93.55 133.52 36.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.673 -0.24 . . . . 10.0 110.686 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.409 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -147.11 132.2 18.28 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.663 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.7 tt -108.08 122.72 62.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.275 0.56 . . . . 10.0 109.907 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.52 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.6 mtt85 -145.33 177.15 9.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.377 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.655 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -122.14 144.09 49.15 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.29 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 38.2 m95 -118.01 171.66 7.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.71 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.1 m -70.8 158.06 88.85 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -59.61 -29.5 90.0 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.179 1.919 . . . . 10.0 111.691 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.96 -3.29 51.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.869 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 61.49 29.96 18.6 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.744 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.29 -34.6 31.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.166 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mmtm -137.56 174.28 10.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.321 0.581 . . . . 10.0 112.113 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.408 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -138.72 172.4 12.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.085 -178.489 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.488 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -141.95 -164.23 9.96 Favored Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.631 -0.795 . . . . 10.0 112.195 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -96.8 143.44 27.72 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.095 -0.65 . . . . 10.0 112.139 -179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.405 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -136.55 -118.49 1.76 Allowed Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 110.338 -1.105 . . . . 10.0 110.338 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -152.4 141.38 14.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 117.59 0.695 . . . . 10.0 110.926 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.536 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.2 m -100.47 142.29 32.14 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.673 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 71.6 mt -120.41 128.78 53.52 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.19 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -77.36 169.23 18.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.29 -48.43 81.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.632 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.607 ' O ' HG23 ' B' ' 64' ' ' VAL . 10.6 pt-20 -62.37 -44.3 96.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.055 0.455 . . . . 10.0 110.486 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -61.31 -54.11 48.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.614 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.413 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -58.05 -40.47 81.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.687 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.55 -51.55 58.15 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 116.024 -0.535 . . . . 10.0 112.552 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.607 HG23 ' O ' ' B' ' 60' ' ' GLU . 15.1 t -65.74 -44.67 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 120.801 0.334 . . . . 10.0 110.387 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.0 -51.75 65.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.919 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 73' ' ' LEU . 95.9 mt -60.48 -51.1 70.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.144 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.07 -57.61 5.58 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.758 0.661 . . . . 10.0 112.142 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.612 ' HB3' HD12 ' A' ' 14' ' ' ILE . 9.3 mm-40 -65.85 -50.39 64.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.068 -0.514 . . . . 10.0 112.146 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.703 ' HB3' HD22 ' A' ' 66' ' ' LEU . 78.6 mt -59.59 -44.97 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -178.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.69 -37.45 94.81 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.188 -0.529 . . . . 10.0 111.921 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -71.94 -27.34 62.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.818 0.342 . . . . 10.0 111.147 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.2 mmtt -66.07 -34.17 77.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.646 0.26 . . . . 10.0 111.051 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.469 HD11 ' CB ' ' A' ' 66' ' ' LEU . 23.6 mt -90.64 8.81 32.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.606 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.242 -0.885 . . . . 10.0 110.575 -180.0 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . 0.438 H2'' ' HD3' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C3'-C2'-C1' 101.603 -0.784 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.846 0 C3'-C2'-C1' 101.502 -0.855 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.914 0 O4'-C1'-C2' 104.16 -1.763 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.846 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O4'--C1' 1.428 0.627 0 O4'-C4'-C3' 103.429 -2.171 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.664 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.885 0 O4'-C4'-C3' 103.411 -2.189 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.863 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.909 0 C5'-C4'-O4' 113.109 2.318 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 C3'-C2'-C1' 101.011 -1.207 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . 0.455 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.872 0 C3'-C2'-C1' 101.627 -0.766 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . 0.423 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.919 0 C3'-C2'-C1' 101.803 -0.641 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.423 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.884 0 O4'-C1'-C2' 104.436 -1.512 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.81 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.804 0 O4'-C4'-C3' 103.569 -2.031 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.728 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.863 0 O4'-C4'-C3' 103.457 -2.143 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.9 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.917 0 C5'-C4'-O4' 113.217 2.386 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.016 0 C3'-C2'-C1' 101.252 -1.034 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 CA-C-O 120.757 0.313 . . . . 10.0 110.895 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.3 158.2 16.78 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.076 -0.342 . . . . 10.0 110.076 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.408 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 7.1 t70 -61.53 -50.06 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 10.0 110.392 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 40.7 mmtm -136.47 100.45 4.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.48 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.777 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 24.9 tp -75.61 140.52 42.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.8 tppt? -75.75 136.14 40.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.91 0.386 . . . . 10.0 110.937 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.475 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 11.4 p90 -158.92 174.85 14.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.506 -0.553 . . . . 10.0 109.506 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.463 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.0 tp10 -156.58 129.13 7.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.732 -0.469 . . . . 10.0 109.732 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.461 ' HA ' HG12 ' A' ' 30' ' ' VAL . 61.1 mt -80.75 119.02 29.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.945 0.402 . . . . 10.0 110.625 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.9 mm -90.33 -48.63 14.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.287 0.565 . . . . 10.0 110.204 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -162.38 128.43 3.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.865 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -74.72 144.65 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.844 -0.799 . . . . 10.0 108.844 178.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 80.4 mt -114.1 -72.98 0.67 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.579 -0.448 . . . . 10.0 112.096 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.649 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.3 mm -131.37 140.58 48.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.472 . . . . 10.0 112.196 -177.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.1 120.07 57.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 177.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.7 mt -89.3 -80.27 0.3 Allowed 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.68 -0.408 . . . . 10.0 111.837 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 m -179.04 -166.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.679 . . . . 10.0 109.168 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.6 mp0 -112.91 144.04 43.16 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.273 0.358 . . . . 10.0 110.366 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -81.57 -173.78 4.6 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -21.74 66.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.674 0.749 . . . . 10.0 110.438 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -87.71 -5.61 58.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.059 -0.973 . . . . 10.0 110.534 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.11 4.26 74.86 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.692 -0.765 . . . . 10.0 111.303 -178.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.501 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -63.14 105.15 0.66 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.817 0.341 . . . . 10.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 43' ' ' THR . 8.1 tpp85 -83.71 100.13 10.69 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.446 178.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HG2' HG22 ' A' ' 43' ' ' THR . 88.8 mttt -82.94 114.95 21.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.112 0.482 . . . . 10.0 110.998 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -131.85 147.89 52.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.517 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.674 HD13 ' HB ' ' A' ' 41' ' ' ILE . 33.9 tp -118.19 109.5 16.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -133.25 161.76 33.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.026 0.441 . . . . 10.0 111.283 -178.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -96.27 113.96 25.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.153 -1.055 . . . . 10.0 108.153 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.461 HG12 ' HA ' ' A' ' 9' ' ' ILE . 16.8 m -129.75 158.53 42.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.698 0.285 . . . . 10.0 111.035 -178.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -95.92 124.85 40.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.001 0.429 . . . . 10.0 110.507 179.098 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -64.52 112.46 3.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.912 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.44 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 57.16 30.85 19.02 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.75 0.656 . . . . 10.0 110.579 -178.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.2 t70 63.02 30.22 16.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 114.708 -1.133 . . . . 10.0 111.096 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.17 -83.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.03 -0.419 . . . . 10.0 111.347 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -96.7 125.12 48.05 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.683 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.516 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.1 Cg_endo -77.93 132.7 11.93 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.726 2.284 . . . . 10.0 111.489 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -151.27 169.12 22.71 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -94.38 123.9 38.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.631 0.253 . . . . 10.0 110.406 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -137.27 129.96 30.16 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.674 ' HB ' HD13 ' A' ' 27' ' ' LEU . 8.8 tt -107.6 123.02 62.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.199 0.523 . . . . 10.0 109.896 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.543 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.1 mtt85 -145.23 179.44 7.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.343 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.558 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -124.3 145.55 49.33 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.953 179.426 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.438 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 44.5 m95 -117.52 170.85 8.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.07 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -69.98 158.22 87.84 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.76 -34.95 92.53 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.605 2.204 . . . . 10.0 112.541 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -91.21 -0.52 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.596 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.2 30.17 19.14 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.786 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -84.46 -33.76 23.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.949 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -136.42 174.68 10.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.537 0.685 . . . . 10.0 111.819 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.484 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -141.27 173.25 11.66 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.702 -177.932 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.645 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.58 -157.36 7.25 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.605 -0.807 . . . . 10.0 112.412 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mttm -96.14 151.01 19.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.496 -0.414 . . . . 10.0 111.934 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.26 -121.16 1.25 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.5 tt -152.75 141.79 14.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.407 0.603 . . . . 10.0 111.229 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.496 ' HB ' ' H71' ' C' ' 7' ' ' ' DT' . 0.3 OUTLIER -105.9 140.82 38.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.707 179.462 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.8 mt -121.15 135.22 55.2 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.398 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 m -76.46 164.31 26.1 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.907 -0.405 . . . . 10.0 109.907 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -58.97 -46.98 86.75 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.98 -44.75 94.29 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.136 0.493 . . . . 10.0 110.315 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.445 ' HB3' HD13 ' B' ' 16' ' ' LEU . 80.4 mt-10 -61.4 -52.05 66.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.746 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.693 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.0 t80 -56.77 -44.29 81.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.311 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.3 -47.73 89.64 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.344 -0.455 . . . . 10.0 112.72 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 92.9 t -68.45 -43.89 83.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.439 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.4 tp -56.35 -49.52 74.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.792 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.693 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.0 mt -64.27 -44.66 91.02 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 121.16 -0.216 . . . . 10.0 111.462 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.2 tttm -54.67 -50.3 68.54 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.477 0.486 . . . . 10.0 110.848 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.548 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 25.2 mm-40 -70.5 -48.76 54.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.425 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 47.8 mt -59.04 -44.2 91.76 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.06 -38.42 95.97 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.411 -0.9 . . . . 10.0 110.996 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -70.09 -25.25 63.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.35 -0.425 . . . . 10.0 110.941 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 29.5 mmmt -67.97 -28.84 67.79 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.039 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 28.7 mt -88.12 -7.8 56.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.876 0.37 . . . . 10.0 110.814 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.523 -0.751 . . . . 10.0 110.172 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 120.767 0.317 . . . . 10.0 110.5 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.48 155.93 19.52 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -60.69 -49.2 78.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 10.0 110.47 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -136.29 101.8 4.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.739 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 26.2 tp -77.74 139.45 39.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.091 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.7 tppt? -75.29 136.43 40.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.111 0.481 . . . . 10.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.562 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 11.0 p90 -160.47 171.73 18.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.31 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.414 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 10.5 tp10 -153.27 130.34 11.09 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.39 116.97 24.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.114 0.483 . . . . 10.0 110.805 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -88.32 -44.54 15.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.554 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -166.94 130.41 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.98 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.83 141.14 40.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 56.4 mt -113.16 -73.64 0.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.492 -0.483 . . . . 10.0 112.056 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.532 HD12 ' CB ' ' A' ' 68' ' ' GLU . 17.0 mm -128.84 139.43 51.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.1 0.476 . . . . 10.0 112.032 -177.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.8 p -124.44 120.69 59.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 61' ' ' GLU . 29.0 mt -91.11 -81.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.875 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -179.16 -166.35 0.09 Allowed 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.506 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -113.03 140.23 48.01 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.882 0.372 . . . . 10.0 110.829 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' ASN . . . . . 0.404 ' OD1' ' HE3' ' B' ' 25' ' ' LYS . 11.9 m120 -77.31 -174.63 3.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.177 178.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.18 -18.79 65.57 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.381 0.61 . . . . 10.0 110.599 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -90.37 -5.72 55.85 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.424 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.58 69.2 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 111.247 -0.741 . . . . 10.0 111.247 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.506 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -64.48 104.92 0.85 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.68 0.276 . . . . 10.0 111.373 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.544 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.7 tpp85 -83.12 101.34 11.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.448 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.559 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.4 mttt -84.29 116.81 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.2 0.524 . . . . 10.0 111.073 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -134.12 146.73 50.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.364 -0.835 . . . . 10.0 110.659 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.719 HD13 ' HB ' ' B' ' 41' ' ' ILE . 39.1 tp -116.63 111.25 19.6 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.2 159.27 42.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.086 0.469 . . . . 10.0 111.296 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -93.38 114.25 26.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 m -130.42 157.82 42.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.921 0.391 . . . . 10.0 111.036 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.515 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 0.1 OUTLIER -95.23 124.59 39.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.585 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -64.17 110.91 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.01 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.0 m-80 58.84 30.03 19.56 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 123.859 0.724 . . . . 10.0 110.473 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.8 t70 64.84 28.02 12.84 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.676 -1.147 . . . . 10.0 111.034 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.15 -83.28 0.59 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.018 -0.426 . . . . 10.0 111.746 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.596 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 30.0 tt0 -96.03 122.48 58.14 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.658 -0.246 . . . . 10.0 111.509 -178.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.515 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.69 129.55 10.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.976 2.451 . . . . 10.0 111.866 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -148.13 169.79 19.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -94.99 122.53 37.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.404 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.409 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -136.48 131.79 34.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.719 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.4 tt -108.92 122.44 63.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.207 0.527 . . . . 10.0 110.02 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.506 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.3 mtt85 -144.89 -179.71 6.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.44 -177.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.559 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -125.25 145.91 49.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.066 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 45.9 m95 -117.84 171.25 8.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.182 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.3 m -70.34 157.93 88.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.9 -0.407 . . . . 10.0 109.9 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -56.07 -32.05 85.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.601 2.201 . . . . 10.0 112.728 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.94 -3.55 51.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.099 0.476 . . . . 10.0 110.263 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 31.82 12.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.973 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -86.34 -30.86 21.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.032 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -137.91 174.41 10.6 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.401 0.62 . . . . 10.0 111.893 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.483 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -141.38 173.07 11.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.883 -1.053 . . . . 10.0 110.324 -177.905 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.668 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.18 -157.24 7.39 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.226 179.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.42 147.13 26.7 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.033 -0.686 . . . . 10.0 111.967 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.98 -119.48 1.64 Allowed Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 110.724 -0.95 . . . . 10.0 110.724 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.5 tt -152.84 143.23 15.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 117.308 0.554 . . . . 10.0 111.005 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.46 140.46 38.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.85 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 48.2 mt -121.27 135.0 55.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.497 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.42 164.44 25.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.15 -0.477 . . . . 10.0 109.866 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -60.32 -44.86 95.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.43 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.479 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.1 pt-20 -63.35 -41.52 98.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.117 0.484 . . . . 10.0 110.637 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -64.07 -50.54 67.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.246 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.477 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -59.22 -41.41 88.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.406 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.23 -50.89 62.99 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.088 -0.577 . . . . 10.0 112.334 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 60' ' ' GLU . 47.6 t -66.12 -45.83 89.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.058 0.456 . . . . 10.0 110.413 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.5 tp -55.3 -49.72 71.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.629 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 76.9 mt -61.77 -47.47 85.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.943 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -54.4 -52.4 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.588 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.649 ' HB3' HD12 ' A' ' 14' ' ' ILE . 7.5 mm-40 -68.82 -50.08 53.11 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.551 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.634 ' HB3' HD22 ' A' ' 66' ' ' LEU . 46.9 mt -60.09 -44.45 94.78 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.674 0.25 . . . . 10.0 111.674 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.07 -35.76 91.93 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.306 -0.718 . . . . 10.0 111.306 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -75.04 -25.19 58.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.87 0.367 . . . . 10.0 110.756 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 23.5 mmmt -64.9 -30.82 71.84 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.179 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.487 HD11 ' CB ' ' A' ' 66' ' ' LEU . 26.7 mt -89.29 0.42 56.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.186 -179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.691 -0.671 . . . . 10.0 109.358 179.158 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.766 0 C3'-C2'-C1' 101.668 -0.737 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C3'-C2'-C1' 101.539 -0.829 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.926 0 O4'-C1'-C2' 104.134 -1.787 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.777 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.521 -0.701 0 O4'-C4'-C3' 103.599 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.403 " O5'" HD22 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 O4'-C4'-C3' 103.552 -2.048 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.845 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.915 0 C5'-C4'-O4' 112.981 2.238 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . 0.496 ' H71' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 C3'-C2'-C1' 101.327 -0.98 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C3'-C2'-C1' 101.399 -0.93 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 C3'-C2'-C1' 101.857 -0.602 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.409 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 O4'-C1'-C2' 104.393 -1.552 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.739 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C4'-C3' 103.638 -1.962 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.514 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C4'-C3' 103.736 -1.864 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.863 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.882 0 C5'-C4'-O4' 112.953 2.22 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.596 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 C3'-C2'-C1' 100.978 -1.23 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.42 ' H2 ' ' P ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 110.035 -0.358 . . . . 10.0 110.035 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.45 165.12 11.99 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.412 ' OD1' ' HG2' ' A' ' 4' ' ' LYS . 13.3 t70 -67.34 -58.71 4.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.156 0.503 . . . . 10.0 110.152 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.412 ' HG2' ' OD1' ' A' ' 3' ' ' ASP . 37.3 mmtm -132.79 104.67 6.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.757 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.833 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 32.5 tp -76.39 141.18 41.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.774 0.321 . . . . 10.0 110.636 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -70.99 130.82 42.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.436 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.521 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 14.7 p90 -157.03 160.84 39.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.767 0.318 . . . . 10.0 110.934 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.474 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.7 tp10 -147.26 126.28 12.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.568 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.459 ' HA ' HG12 ' A' ' 30' ' ' VAL . 62.2 mt -82.69 106.12 13.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.15 0.5 . . . . 10.0 110.237 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.4 mm -76.49 -41.94 35.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.766 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -166.84 126.91 1.53 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.862 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -75.5 143.12 42.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 77.0 mt -110.01 -75.87 0.62 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.352 -0.539 . . . . 10.0 111.794 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.66 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.9 mm -128.49 137.34 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.53 . . . . 10.0 112.006 -177.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.411 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.5 p -119.83 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 177.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.539 HD22 ' HB ' ' B' ' 64' ' ' VAL . 32.0 mt -92.28 -80.92 0.35 Allowed 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.568 -0.453 . . . . 10.0 111.862 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.84 -168.72 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.527 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -110.34 147.76 33.29 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -83.27 -168.83 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.77 -21.45 65.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.548 0.69 . . . . 10.0 110.317 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -91.5 1.06 57.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.95 -1.023 . . . . 10.0 110.718 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.74 4.77 88.68 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.58 -0.819 . . . . 10.0 111.395 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.527 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.24 103.28 0.37 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.89 0.376 . . . . 10.0 110.994 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.533 ' O ' ' HA ' ' A' ' 43' ' ' THR . 11.3 tpp85 -83.8 100.69 11.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.571 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.564 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.0 mttt -83.4 115.12 21.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.066 0.46 . . . . 10.0 110.828 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.411 ' HG2' HG23 ' A' ' 15' ' ' VAL . 79.8 mt-10 -131.4 143.54 50.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.47 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.71 HD13 ' HB ' ' A' ' 41' ' ' ILE . 40.0 tp -112.43 108.29 17.39 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.157 -1.053 . . . . 10.0 108.157 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -131.54 160.64 34.66 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 10.0 111.213 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -97.11 113.73 25.33 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.501 -0.925 . . . . 10.0 108.501 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.459 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.5 m -127.46 157.0 39.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 120.928 0.394 . . . . 10.0 110.767 -179.252 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -95.95 125.81 40.76 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.176 178.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -64.62 110.21 2.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.959 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 60.66 27.53 17.25 Favored 'General case' 0 C--O 1.235 0.294 0 O-C-N 124.061 0.851 . . . . 10.0 110.624 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.6 t70 68.41 23.63 7.47 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.91 -1.041 . . . . 10.0 110.709 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.99 -84.67 0.54 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.102 -0.373 . . . . 10.0 111.666 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -91.63 123.27 64.05 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.516 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 62.8 Cg_endo -80.79 124.13 4.97 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.766 2.311 . . . . 10.0 111.808 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -143.08 170.03 16.47 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -96.1 126.57 41.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.684 0.278 . . . . 10.0 110.466 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.433 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -140.4 130.06 24.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.71 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.5 tt -106.55 124.32 61.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.354 0.597 . . . . 10.0 110.019 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.514 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.7 mtt85 -144.66 176.75 9.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.214 -177.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.564 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -123.63 142.11 51.36 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.796 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -117.58 170.66 8.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.932 -0.576 . . . . 10.0 109.616 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.11 159.08 73.59 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -57.81 -31.63 92.84 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.237 1.958 . . . . 10.0 111.773 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -91.57 -1.94 57.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.412 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 60.0 31.41 20.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.804 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -83.8 -33.14 25.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.165 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -135.74 174.88 10.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.366 0.603 . . . . 10.0 111.558 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.441 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -139.33 167.72 21.44 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.818 -1.083 . . . . 10.0 110.769 -177.791 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.651 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -135.11 -162.4 9.73 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.16 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -95.59 151.01 19.71 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.245 -0.562 . . . . 10.0 111.797 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.13 -125.43 1.61 Allowed Glycine 0 C--N 1.331 0.262 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.365 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.0 143.43 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.518 0.659 . . . . 10.0 111.259 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.432 ' HB ' ' H71' ' C' ' 7' ' ' ' DT' . 0.5 OUTLIER -105.92 140.06 39.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.572 179.732 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.4 mt -119.78 134.22 55.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.27 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.5 m -79.17 169.55 17.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.325 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.44 -49.8 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.707 0.262 . . . . 10.0 111.707 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -60.98 -43.47 98.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.548 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -61.03 -50.77 71.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.586 -0.733 . . . . 10.0 110.441 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.719 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.3 t80 -56.46 -45.84 80.66 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.239 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.89 -51.47 58.4 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.296 -0.478 . . . . 10.0 112.901 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.2 t -64.96 -42.69 95.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 10.0 110.664 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.7 tp -57.62 -51.83 67.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.807 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.719 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -62.84 -45.47 92.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.47 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -52.65 -51.37 60.42 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.208 0.528 . . . . 10.0 111.246 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 9.6 mm-40 -71.41 -47.49 55.66 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.809 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.513 ' HB3' HD22 ' B' ' 66' ' ' LEU . 48.4 mt -58.4 -44.46 88.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.574 0.226 . . . . 10.0 111.604 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.9 -40.41 99.24 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.577 -0.82 . . . . 10.0 111.143 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -68.53 -26.54 65.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.326 . . . . 10.0 110.728 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 68.3 mmtt -69.66 -27.04 64.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.022 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.445 HD11 ' HB3' ' B' ' 66' ' ' LEU . 35.7 mt -82.37 -25.46 33.78 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.073 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.618 -0.706 . . . . 10.0 110.465 -179.713 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.419 ' H2 ' ' P ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.331 . . . . 10.0 110.223 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.36 171.33 8.64 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.439 ' OD1' ' HG2' ' B' ' 4' ' ' LYS . 13.1 t70 -74.22 -56.6 4.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.03 0.443 . . . . 10.0 110.059 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.439 ' HG2' ' OD1' ' B' ' 3' ' ' ASP . 41.9 mmtm -134.08 101.65 5.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.76 -0.654 . . . . 10.0 109.372 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.774 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 37.1 tp -74.56 137.79 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.151 -0.314 . . . . 10.0 110.151 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -70.33 128.56 36.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.785 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.61 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 15.3 p90 -153.5 163.35 40.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.392 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.463 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 11.5 tp10 -150.16 122.9 8.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.436 ' HA ' HG12 ' B' ' 30' ' ' VAL . 56.8 mt -79.07 109.9 14.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.144 0.497 . . . . 10.0 110.555 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.9 mm -79.13 -41.75 23.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.616 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -166.61 125.47 1.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.49 139.41 42.19 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 50.0 mt -108.46 -73.78 0.68 Allowed 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.385 -0.526 . . . . 10.0 112.294 -177.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.495 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.5 mm -128.01 132.22 68.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -177.003 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.414 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.8 p -115.77 122.37 69.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 177.042 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.1 mt -93.51 -80.83 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.754 -0.379 . . . . 10.0 111.84 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.8 m 178.94 -169.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.473 -0.565 . . . . 10.0 109.473 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.27 148.07 30.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.582 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -84.28 -171.92 3.88 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -18.69 65.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.383 0.611 . . . . 10.0 110.699 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' LYS . . . . . 0.434 ' HG2' ' C2 ' ' C' ' 11' ' ' ' DT' . 20.7 mttt -92.61 -3.32 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.606 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.82 4.13 76.03 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.418 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.514 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.2 m0 -62.06 104.01 0.43 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.747 0.308 . . . . 10.0 111.02 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.5 tpp85 -84.45 100.75 11.53 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 179.098 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.629 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.4 mttt -82.25 116.24 21.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.016 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.414 ' HG2' HG23 ' B' ' 15' ' ' VAL . 62.0 mt-10 -132.56 141.3 48.65 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.744 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.689 HD13 ' HB ' ' B' ' 41' ' ' ILE . 40.8 tp -110.79 108.11 17.84 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -131.78 159.14 39.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.936 0.398 . . . . 10.0 111.385 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -94.8 113.58 25.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' B' ' 9' ' ' ILE . 14.7 m -126.88 157.79 37.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.884 0.373 . . . . 10.0 110.773 -179.076 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.1 p -97.26 125.5 41.86 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.32 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -64.53 110.4 2.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.932 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 59.24 30.09 19.77 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.504 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 34.0 t70 66.48 20.85 10.87 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.512 -1.222 . . . . 10.0 111.142 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -87.4 0.45 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.803 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.607 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 30.8 tt0 -89.87 122.4 67.96 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-O 120.658 0.266 . . . . 10.0 111.64 -178.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 59.5 Cg_endo -79.47 125.24 6.18 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.86 2.374 . . . . 10.0 111.954 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.423 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 20.1 ttmm -144.12 169.88 17.01 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' TYR . . . . . 0.423 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 3.2 m-85 -97.24 125.45 41.81 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.441 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.77 129.32 24.33 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.689 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.4 tt -105.12 124.08 59.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.249 0.547 . . . . 10.0 110.044 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.519 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 2.7 mtt85 -144.29 175.62 9.95 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.346 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.629 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -122.21 142.0 50.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.048 179.698 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -117.73 169.75 9.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.452 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 158.83 73.67 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -56.08 -34.55 93.02 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.153 1.902 . . . . 10.0 111.602 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -88.38 -4.19 58.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.555 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.72 34.93 19.81 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.349 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.68 -34.82 21.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.723 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -134.04 174.34 10.59 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.268 0.556 . . . . 10.0 111.568 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.439 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -137.89 167.79 21.02 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.607 -1.179 . . . . 10.0 110.4 -178.196 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.654 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -135.0 -161.46 9.42 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.955 -0.64 . . . . 10.0 112.387 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -96.75 148.28 23.05 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.432 -0.452 . . . . 10.0 111.57 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.86 -124.5 1.81 Allowed Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 111.323 -0.711 . . . . 10.0 111.323 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -148.21 142.23 19.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 117.499 0.65 . . . . 10.0 111.129 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.4 HG22 ' HD2' ' B' ' 38' ' ' LYS . 0.7 OUTLIER -103.88 139.01 39.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.918 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 133.16 56.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.477 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.7 m -78.26 170.6 16.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.25 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.32 -52.58 64.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.294 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.579 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.9 pt-20 -58.97 -42.36 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.098 0.475 . . . . 10.0 110.641 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -62.4 -50.19 72.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.667 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.544 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.2 t80 -57.65 -43.19 84.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.586 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.69 -51.77 56.58 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.36 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.579 HG23 ' O ' ' B' ' 60' ' ' GLU . 35.5 t -62.57 -45.84 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 10.0 110.422 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.6 tp -56.43 -53.29 59.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.373 -0.83 . . . . 10.0 110.721 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 32.4 mt -59.9 -48.8 80.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.249 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -52.2 -53.65 40.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.757 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.66 ' HB3' HD12 ' A' ' 14' ' ' ILE . 8.9 mm-40 -69.92 -48.53 58.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.973 -178.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.61 ' HB3' HD22 ' A' ' 66' ' ' LEU . 47.6 mt -59.12 -42.95 91.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.551 0.215 . . . . 10.0 111.418 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.12 -38.97 97.01 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.599 -0.81 . . . . 10.0 111.294 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' ASN . . . . . 0.448 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.9 t-20 -71.05 -27.46 63.66 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 10.0 110.915 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.0 mmtt -66.99 -26.03 66.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.367 -0.379 . . . . 10.0 111.553 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.525 HD11 ' CB ' ' A' ' 66' ' ' LEU . 23.1 mt -89.62 -13.6 36.75 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.546 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.448 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 42.9 mt-10 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.632 -0.699 . . . . 10.0 110.3 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 C3'-C2'-C1' 101.655 -0.747 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 101.494 -0.862 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.405 -1.131 0 O4'-C1'-C2' 104.127 -1.794 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.833 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.844 0 O4'-C4'-C3' 103.481 -2.119 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.514 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C4'-C3' 103.656 -1.944 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.825 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.533 0.829 0 C5'-C4'-O4' 112.88 2.175 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . 0.432 ' H71' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.427 -0.831 0 C3'-C2'-C1' 101.514 -0.847 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . 0.434 ' C2 ' ' HG2' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 C3'-C2'-C1' 101.624 -0.768 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.808 0 C3'-C2'-C1' 101.865 -0.596 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.938 0 O4'-C1'-C2' 104.357 -1.585 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.774 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 O4'-C4'-C3' 103.517 -2.083 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.519 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.885 0 O4'-C4'-C3' 103.864 -1.736 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.793 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.937 0 C5'-C4'-O4' 112.964 2.228 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.607 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 C3'-C2'-C1' 101.08 -1.157 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.7 mmm . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 120.916 0.389 . . . . 10.0 110.304 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.47 179.91 4.13 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.061 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -82.8 -60.73 2.08 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -131.13 94.64 3.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.068 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.764 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 27.7 tp -71.16 139.46 50.22 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.801 0.334 . . . . 10.0 110.272 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -71.75 137.46 47.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.957 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.6 p90 -161.44 172.15 16.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.934 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -155.44 138.13 15.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.436 ' HA ' HG12 ' A' ' 30' ' ' VAL . 54.8 mt -85.47 113.64 24.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.923 0.392 . . . . 10.0 110.335 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.07 -44.05 17.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.964 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -167.78 128.59 1.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.331 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -79.62 136.5 36.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.498 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 58.3 mt -106.99 -75.08 0.64 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.386 0.514 . . . . 10.0 112.386 -178.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.765 HD12 ' HB3' ' B' ' 68' ' ' GLU . 31.8 mm -127.07 140.93 47.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 112.596 0.591 . . . . 10.0 112.596 -177.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.454 HG23 ' HG2' ' A' ' 26' ' ' GLU . 5.1 p -121.2 123.22 69.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 177.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.416 HD22 ' HB ' ' B' ' 64' ' ' VAL . 31.1 mt -92.25 -81.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.542 -0.463 . . . . 10.0 111.572 -178.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -179.98 -174.8 0.28 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 122.748 0.419 . . . . 10.0 110.006 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.586 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 26.5 mp0 -111.12 156.81 20.81 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -102.99 -169.94 1.72 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.003 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.9 -23.43 67.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.391 0.615 . . . . 10.0 110.515 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -87.82 -4.66 58.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.511 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.03 3.56 87.61 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.759 -0.655 . . . . 10.0 112.063 -178.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.586 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 42.0 m0 -55.24 102.54 0.07 Allowed 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.373 0.269 . . . . 10.0 111.649 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.557 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.4 tpp85 -80.22 100.3 8.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.417 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 81.0 mttt -82.35 113.2 19.97 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.89 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.454 ' HG2' HG23 ' A' ' 15' ' ' VAL . 53.0 mt-10 -139.26 153.9 47.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.35 0.595 . . . . 10.0 111.743 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.741 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.5 tp -123.07 107.67 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.933 -1.03 . . . . 10.0 108.26 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -133.94 166.11 23.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.927 0.394 . . . . 10.0 110.88 -177.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.4 ttp180 -105.58 114.9 29.35 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.184 -0.673 . . . . 10.0 109.184 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.8 m -126.15 162.12 30.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.498 -179.134 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.427 ' HA ' ' O ' ' A' ' 36' ' ' GLU . 1.0 OUTLIER -99.29 123.12 43.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.948 0.404 . . . . 10.0 110.515 179.136 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.521 ' CH2' ' H72' ' C' ' 7' ' ' ' DT' . 14.7 m0 -64.73 112.86 3.42 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.837 -0.619 . . . . 10.0 109.619 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 59.7 26.1 15.16 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.806 0.692 . . . . 10.0 110.207 -178.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t0 63.52 28.48 15.29 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.614 -1.176 . . . . 10.0 110.96 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.69 -74.66 0.61 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.068 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' A' ' 31' ' ' SER . 45.7 tt0 -91.01 118.09 68.34 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.526 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -82.58 120.79 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.601 2.201 . . . . 10.0 110.667 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -150.06 163.07 39.11 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.796 -0.362 . . . . 10.0 110.771 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -83.47 139.48 32.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.538 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -151.05 130.61 13.01 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.741 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -108.83 123.7 64.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.238 0.542 . . . . 10.0 110.111 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.476 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.1 mtt85 -149.1 174.4 12.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.222 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.557 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 2.9 p -123.25 135.52 54.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 49.1 m0 -116.8 176.62 5.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.592 0.234 . . . . 10.0 110.693 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -66.86 153.64 93.71 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.406 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.41 -37.97 77.68 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.387 2.058 . . . . 10.0 111.561 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -83.76 -4.08 58.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.221 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 62.35 24.93 14.87 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.468 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -76.52 -31.73 57.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.973 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -140.07 174.13 10.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.33 0.586 . . . . 10.0 111.475 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.31 171.22 14.75 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.432 -178.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.504 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -138.15 -170.0 11.75 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.497 -0.859 . . . . 10.0 112.285 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -98.38 145.38 26.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.461 -0.435 . . . . 10.0 111.894 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.83 -111.87 0.85 Allowed Glycine 0 N--CA 1.453 -0.2 0 N-CA-C 110.952 -0.859 . . . . 10.0 110.952 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 tt -155.93 141.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 117.306 0.553 . . . . 10.0 110.803 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.2 m -98.44 141.67 31.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.139 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.3 mt -119.62 122.47 41.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.098 0.475 . . . . 10.0 110.543 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -80.93 168.34 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.578 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.13 -38.37 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.577 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.485 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -59.41 -47.84 83.92 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.388 178.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.485 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 29.5 mt-10 -66.96 -56.7 9.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.975 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.734 ' CE2' HD11 ' A' ' 66' ' ' LEU . 9.5 t80 -50.35 -45.84 55.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.437 -0.801 . . . . 10.0 111.956 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.1 -56.48 25.02 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.195 -0.526 . . . . 10.0 113.126 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.17 -43.53 91.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 10.0 111.14 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.0 tp -55.58 -51.61 66.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.973 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.751 HD22 ' HB3' ' B' ' 69' ' ' LEU . 20.5 mt -62.83 -45.47 92.45 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 121.002 -0.279 . . . . 10.0 111.121 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 ttpp -53.82 -52.63 59.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.89 -0.595 . . . . 10.0 111.005 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 15.8 mm-40 -69.69 -49.11 56.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.905 -178.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.9 mt -58.32 -44.78 88.81 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.624 0.25 . . . . 10.0 111.404 -179.162 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.24 -35.66 92.25 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.405 -0.902 . . . . 10.0 111.348 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -74.57 -18.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.867 0.365 . . . . 10.0 110.81 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 66.2 mmtt -75.19 -26.2 58.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.057 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' B' ' 66' ' ' LEU . 28.1 mt -90.1 -3.31 57.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.938 0.399 . . . . 10.0 110.565 179.088 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 118.481 -0.771 . . . . 10.0 110.336 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 90.3 mmm . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 120.878 0.37 . . . . 10.0 110.424 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.54 178.43 4.56 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.451 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -82.06 -58.25 3.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -131.79 94.04 3.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.226 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.702 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 27.4 tp -70.63 139.08 51.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.253 179.372 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -73.02 134.96 44.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 10.0 110.893 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.579 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 11.3 p90 -158.78 170.52 21.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.882 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.494 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.5 tp10 -153.08 134.35 14.22 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.41 ' HA ' HG12 ' B' ' 30' ' ' VAL . 52.2 mt -82.73 110.48 17.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.966 0.412 . . . . 10.0 110.413 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.4 mm -79.8 -48.61 20.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.635 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -164.96 129.46 2.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.229 -179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.93 144.51 36.78 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 57.8 mt -115.08 -70.75 0.78 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.231 -0.588 . . . . 10.0 112.433 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.551 HD12 ' HB3' ' A' ' 68' ' ' GLU . 15.3 mm -128.45 142.54 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.926 0.393 . . . . 10.0 111.847 -176.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.51 118.54 52.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.6 mt -88.23 -80.94 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -177.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 178.46 -172.24 0.13 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.596 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 24.0 mp0 -115.15 151.78 33.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.312 -0.403 . . . . 10.0 109.999 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' ASN . . . . . 0.401 ' HA ' HD22 ' B' ' 19' ' ' ASN . 3.3 m120 -96.82 -167.88 1.62 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -15.17 63.44 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.345 0.593 . . . . 10.0 110.601 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -94.41 -2.01 52.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.957 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.31 4.31 90.23 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.275 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.596 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.6 m0 -56.94 102.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.5 tpp85 -80.15 100.6 8.33 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.408 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 78.7 mttt -82.25 113.76 20.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.898 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -139.83 155.1 47.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.438 0.637 . . . . 10.0 111.747 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.717 HD13 ' HB ' ' B' ' 41' ' ' ILE . 37.3 tp -124.24 107.91 11.7 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.191 -1.04 . . . . 10.0 108.191 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -133.9 164.42 27.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.918 0.39 . . . . 10.0 110.927 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.1 ttp180 -104.13 114.3 28.44 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.4 m -125.25 162.1 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.748 -179.045 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.494 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -99.79 121.81 41.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.505 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' TRP . . . . . 0.539 ' CH2' ' H73' ' C' ' 17' ' ' ' DT' . 17.1 m0 -64.2 112.88 3.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.763 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 59.75 26.18 15.28 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.014 -178.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.0 t0 61.3 33.4 19.0 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 114.517 -1.22 . . . . 10.0 110.491 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.92 -70.05 0.81 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.064 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' B' ' 31' ' ' SER . 44.2 tt0 -94.92 117.58 66.83 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.601 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -81.64 120.16 3.47 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.372 2.048 . . . . 10.0 110.708 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 11.0 ttpt -150.24 163.23 38.81 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.804 -0.358 . . . . 10.0 110.708 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.88 138.51 32.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.347 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -150.04 130.5 13.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.717 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.2 tt -108.53 123.13 64.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.388 0.613 . . . . 10.0 110.14 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.57 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.9 mtt85 -149.03 175.47 11.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.574 -178.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.553 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 4.5 p -124.31 135.4 53.33 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -117.02 175.1 5.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.424 -0.213 . . . . 10.0 110.424 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.7 m -65.49 153.85 89.32 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.452 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.08 -34.97 89.07 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.424 2.083 . . . . 10.0 111.319 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.57 -4.75 59.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.049 -0.978 . . . . 10.0 110.23 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 61.98 23.81 14.08 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.783 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -76.7 -29.7 56.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -141.48 174.53 10.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.557 0.694 . . . . 10.0 111.953 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.15 171.8 13.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.32 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.454 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -139.72 -170.64 12.01 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.238 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.9 mttp -97.57 141.61 30.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.256 0.55 . . . . 10.0 112.426 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -138.57 -119.32 1.72 Allowed Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.386 -1.086 . . . . 10.0 110.386 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -149.43 143.14 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 117.27 0.535 . . . . 10.0 110.674 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 4.0 m -97.81 139.57 33.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.524 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -117.75 119.29 34.46 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.967 0.413 . . . . 10.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.7 166.93 21.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.314 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.0 -35.17 74.46 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.874 0.368 . . . . 10.0 110.922 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.452 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.9 pt-20 -61.75 -46.07 91.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.062 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.452 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 31.3 mt-10 -68.34 -57.21 6.27 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.863 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.5 t80 -52.15 -42.28 63.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.463 -0.789 . . . . 10.0 111.478 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.99 -55.52 30.43 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.875 -0.678 . . . . 10.0 112.954 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.416 ' HB ' HD22 ' A' ' 16' ' ' LEU . 19.1 t -68.66 -42.36 83.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.937 0.399 . . . . 10.0 110.865 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.0 tp -56.59 -50.93 70.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.021 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 60.1 mt -60.62 -50.69 72.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.726 0.298 . . . . 10.0 110.606 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 24.8 tttm -50.84 -53.04 35.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.8 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.765 ' HB3' HD12 ' A' ' 14' ' ' ILE . 30.6 mm-40 -69.4 -52.45 26.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.282 -178.151 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.751 ' HB3' HD22 ' A' ' 66' ' ' LEU . 62.4 mt -58.87 -43.13 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.91 -38.23 96.22 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.47 -0.872 . . . . 10.0 111.142 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' ASN . . . . . 0.408 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.4 t-20 -73.51 -20.06 60.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.504 -0.348 . . . . 10.0 111.359 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.8 mmtt -72.64 -27.51 62.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.658 0.266 . . . . 10.0 110.95 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.88 0.46 57.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.984 0.421 . . . . 10.0 111.019 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.408 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.9 mt-10 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.789 -0.624 . . . . 10.0 109.892 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 101.73 -0.693 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . 0.533 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 101.315 -0.989 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . 0.533 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.889 0 O4'-C1'-C2' 104.053 -1.861 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.764 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.855 0 O4'-C4'-C3' 103.567 -2.033 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.476 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 O4'-C4'-C3' 103.521 -2.079 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.781 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.787 0 C5'-C4'-O4' 113.084 2.302 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . 0.521 ' H72' ' CH2' ' A' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.423 -1.04 0 C3'-C2'-C1' 101.179 -1.086 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.797 0 C3'-C2'-C1' 101.394 -0.933 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . 0.509 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.901 0 C3'-C2'-C1' 101.913 -0.562 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.509 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.83 0 O4'-C1'-C2' 104.36 -1.582 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.702 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.519 -0.9 0 O4'-C4'-C3' 103.599 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.57 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.976 0 O4'-C4'-C3' 103.714 -1.886 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.798 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.831 0 C5'-C4'-O4' 113.154 2.346 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.539 ' H73' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 C3'-C2'-C1' 100.971 -1.235 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.756 0.312 . . . . 10.0 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.46 160.23 17.98 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -66.96 -53.4 32.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.236 -0.653 . . . . 10.0 109.236 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -139.98 95.23 2.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.195 -0.911 . . . . 10.0 109.697 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.735 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.5 tp -64.22 145.77 55.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.852 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.1 tppt? -79.25 136.48 37.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.47 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -164.32 163.53 22.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.189 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.458 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.8 tp10 -145.4 126.09 14.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.533 ' HA ' HG12 ' A' ' 30' ' ' VAL . 84.6 mt -73.83 110.77 8.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.002 0.429 . . . . 10.0 110.147 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mm -80.68 -48.89 19.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -162.96 126.65 2.88 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.042 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -78.39 144.31 36.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 68.7 mt -112.44 -75.46 0.61 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.565 -0.454 . . . . 10.0 111.625 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.566 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.0 mm -128.87 140.35 49.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.304 0.573 . . . . 10.0 112.49 -177.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.452 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.4 p -123.59 120.45 60.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 107.85 -1.167 . . . . 10.0 107.85 177.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.601 HD22 ' HB ' ' B' ' 64' ' ' VAL . 32.5 mt -89.72 -81.68 0.28 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.567 -0.453 . . . . 10.0 112.124 -177.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.2 m -174.51 -168.39 0.37 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -107.44 136.57 47.01 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.827 -0.435 . . . . 10.0 109.827 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -74.43 -173.83 1.85 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.793 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.06 68.45 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.614 0.721 . . . . 10.0 110.574 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -88.66 -1.07 57.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.811 -1.086 . . . . 10.0 110.91 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.36 1.62 81.01 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.125 -0.79 . . . . 10.0 111.125 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -59.06 106.05 0.38 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.838 0.351 . . . . 10.0 111.318 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.523 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.4 tpp85 -84.53 99.74 10.93 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.504 178.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.445 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.3 mttt -82.91 118.29 23.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.425 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.452 ' HG2' HG23 ' A' ' 15' ' ' VAL . 62.6 mt-10 -133.56 149.79 51.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.986 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 40.3 tp -117.76 108.11 14.97 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.612 -0.884 . . . . 10.0 108.612 178.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -135.63 160.97 36.85 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.791 0.329 . . . . 10.0 110.451 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 ttp180 -102.19 115.0 29.63 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.533 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.2 m -125.26 161.85 28.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.691 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.458 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.4 p -93.39 124.52 37.44 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -63.66 108.28 1.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.443 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 61.8 m-80 59.28 30.36 20.08 Favored 'General case' 0 CA--C 1.522 -0.108 0 O-C-N 123.869 0.73 . . . . 10.0 109.703 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 44.1 t0 62.91 26.69 15.67 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.365 -1.289 . . . . 10.0 111.09 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.26 -71.2 0.76 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.128 -0.357 . . . . 10.0 111.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -94.16 114.79 64.13 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.853 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 53.5 Cg_endo -78.27 119.9 4.74 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.164 1.909 . . . . 10.0 110.282 177.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.434 ' HE3' HG21 ' A' ' 56' ' ' THR . 20.7 ttpt -150.03 166.23 30.33 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.889 -0.324 . . . . 10.0 110.489 -178.158 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -87.01 132.16 33.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 10.0 110.867 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.415 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -144.8 132.96 21.57 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.49 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -109.88 121.83 63.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.356 0.598 . . . . 10.0 109.824 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.506 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtt85 -144.74 179.44 7.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.281 -177.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -128.05 146.01 50.81 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.197 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -117.23 178.16 4.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.938 -0.573 . . . . 10.0 109.783 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.404 ' HG ' ' H ' ' A' ' 50' ' ' LYS . 1.3 p -80.36 161.41 64.97 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -57.63 -29.78 86.46 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.368 2.045 . . . . 10.0 112.612 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -100.5 0.16 39.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.135 0.493 . . . . 10.0 110.323 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 59.14 34.19 23.16 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.219 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.14 -37.22 22.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.102 0.477 . . . . 10.0 110.327 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.404 ' H ' ' HG ' ' A' ' 45' ' ' SER . 43.5 mmtm -139.35 174.38 10.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.912 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.422 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -150.55 173.04 14.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.758 -177.957 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.6 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -133.42 -162.08 9.99 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.779 -0.724 . . . . 10.0 112.212 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -90.08 162.5 15.29 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.361 -0.493 . . . . 10.0 112.243 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -152.78 -121.63 0.89 Allowed Glycine 0 C--N 1.33 0.229 0 CA-C-N 115.248 -0.887 . . . . 10.0 111.277 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.2 tt -153.66 143.17 14.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 117.48 0.64 . . . . 10.0 110.969 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.434 HG21 ' HE3' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -105.01 145.73 30.03 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.955 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -125.94 132.11 52.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.007 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -75.36 161.61 29.12 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -57.12 -46.23 82.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.559 -179.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.49 -46.13 91.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.944 0.402 . . . . 10.0 110.585 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -59.52 -49.59 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.355 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.738 ' CE2' HD11 ' A' ' 66' ' ' LEU . 15.6 t80 -57.07 -43.84 82.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.22 -0.9 . . . . 10.0 111.356 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.43 -56.3 25.99 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.717 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.87 -41.28 88.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.912 0.387 . . . . 10.0 110.373 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.445 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 17.4 tp -58.2 -54.6 45.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.872 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.738 HD11 ' CE2' ' A' ' 62' ' ' PHE . 22.2 mt -62.44 -46.29 89.19 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.757 -0.201 . . . . 10.0 111.465 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 tttm -50.4 -49.98 53.03 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.603 0.564 . . . . 10.0 111.459 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 13.3 mm-40 -72.35 -48.67 40.11 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.414 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.475 ' HB3' HD22 ' B' ' 66' ' ' LEU . 84.1 mt -57.41 -44.98 85.04 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.144 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.05 98.75 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.686 -0.769 . . . . 10.0 111.372 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.469 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 13.1 t-20 -68.06 -28.31 67.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.955 0.407 . . . . 10.0 111.057 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.6 mmtt -67.41 -28.9 68.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.087 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.644 HD11 ' HB3' ' B' ' 66' ' ' LEU . 50.5 mt -89.68 -4.86 57.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.682 -0.236 . . . . 10.0 111.126 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 41.1 mt-10 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.42 -0.8 . . . . 10.0 110.722 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.865 0.364 . . . . 10.0 110.406 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.4 161.78 13.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.2 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.01 -51.81 29.3 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -139.98 94.51 2.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.212 -0.904 . . . . 10.0 109.313 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.711 HD13 H5'' ' C' ' 15' ' ' ' DT' . 25.3 tp -62.35 145.12 54.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.121 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -79.43 134.08 36.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.658 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.563 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 7.4 p90 -163.44 161.71 24.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.449 179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -142.38 130.22 21.7 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.45 ' HA ' HG12 ' B' ' 30' ' ' VAL . 65.5 mt -78.26 105.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.939 0.4 . . . . 10.0 110.802 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 40.8 mm -75.99 -47.42 32.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.619 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -164.04 127.33 2.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.08 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -79.67 141.72 36.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.5 mt -112.09 -72.98 0.69 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.381 -0.528 . . . . 10.0 112.354 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.501 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.6 mm -127.81 140.39 49.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.107 0.48 . . . . 10.0 112.074 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -125.26 115.47 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -84.94 -82.19 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.207 0.447 . . . . 10.0 112.207 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.0 m -177.42 -167.9 0.17 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -107.03 138.25 43.55 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -76.93 -172.67 2.4 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.868 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.87 -13.92 62.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.41 0.624 . . . . 10.0 111.417 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -101.14 2.27 40.02 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.885 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 2.22 85.2 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.269 -178.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 41.1 m0 -59.93 106.06 0.46 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.975 0.417 . . . . 10.0 111.484 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.511 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.1 tpp85 -84.57 100.03 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.646 178.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -82.53 118.73 23.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.908 0.385 . . . . 10.0 110.486 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -133.54 148.32 51.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.93 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.553 HD13 ' HB ' ' B' ' 41' ' ' ILE . 41.4 tp -118.03 107.74 14.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.412 -0.959 . . . . 10.0 108.412 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -135.99 162.5 32.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.893 0.377 . . . . 10.0 110.743 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -103.2 114.83 29.44 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.4 m -123.85 162.2 25.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.46 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.1 p -93.91 123.41 37.25 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.865 -0.421 . . . . 10.0 109.865 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.21 108.01 1.18 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.7 m-80 60.05 29.26 18.84 Favored 'General case' 0 CA--C 1.523 -0.082 0 O-C-N 123.707 0.629 . . . . 10.0 109.773 -177.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t0 61.27 34.57 18.56 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.7 -1.136 . . . . 10.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.09 -71.61 0.72 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.083 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -91.77 114.58 62.41 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.385 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.411 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 39.3 Cg_endo -80.64 118.7 3.54 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.773 1.649 . . . . 10.0 109.964 178.056 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -148.23 166.62 27.39 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 110.217 -0.29 . . . . 10.0 110.217 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -87.56 132.79 33.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.583 -0.281 . . . . 10.0 110.666 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -145.57 132.07 19.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.99 -0.744 . . . . 10.0 108.99 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.553 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.3 tt -108.94 121.65 62.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.442 0.639 . . . . 10.0 109.915 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.447 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.2 mtt85 -144.11 179.88 6.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.307 -178.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -128.86 146.3 50.97 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.402 -179.762 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -117.56 176.66 5.07 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.941 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -77.64 161.15 72.94 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.211 -0.662 . . . . 10.0 109.211 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.41 -30.25 87.31 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.268 1.979 . . . . 10.0 112.16 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -97.14 -4.98 38.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.74 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 64.01 29.83 14.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.558 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -82.35 -37.31 25.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.111 0.481 . . . . 10.0 110.293 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -137.54 171.77 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.984 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.405 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -148.82 173.13 13.6 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.577 -178.068 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.644 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -132.86 -158.45 8.84 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.849 -0.691 . . . . 10.0 112.271 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -92.64 160.63 14.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.16 0.505 . . . . 10.0 112.307 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.405 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -152.31 -127.95 1.33 Allowed Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.654 -0.979 . . . . 10.0 110.654 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.5 tt -147.98 143.32 19.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 117.511 0.656 . . . . 10.0 111.24 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -103.67 145.02 30.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.685 -0.688 . . . . 10.0 111.132 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 81.5 mt -125.8 131.63 52.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.266 -0.424 . . . . 10.0 109.99 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -75.29 161.33 29.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.17 -47.0 82.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.702 0.287 . . . . 10.0 111.657 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.477 ' O ' HG23 ' B' ' 64' ' ' VAL . 12.1 pt-20 -62.17 -42.16 99.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.987 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -63.12 -48.72 77.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.868 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.528 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -59.29 -40.19 85.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.756 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.28 -56.06 27.3 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.176 -0.535 . . . . 10.0 112.625 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.601 ' HB ' HD22 ' A' ' 16' ' ' LEU . 8.1 t -62.16 -41.69 92.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.001 0.429 . . . . 10.0 110.486 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.3 tp -58.03 -54.48 46.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.048 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.644 ' HB3' HD11 ' A' ' 73' ' ' LEU . 51.1 mt -61.31 -48.45 81.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.577 -0.283 . . . . 10.0 111.219 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -49.57 -52.71 28.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.844 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 8.0 mm-40 -71.31 -48.22 51.9 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.958 -178.509 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.592 ' HB3' HD22 ' A' ' 66' ' ' LEU . 60.5 mt -58.57 -45.24 89.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.71 -0.223 . . . . 10.0 111.56 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.64 96.24 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.685 -0.769 . . . . 10.0 111.358 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' ASN . . . . . 0.553 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.6 t-20 -70.9 -26.61 63.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.931 0.396 . . . . 10.0 111.149 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.3 mmtt -68.28 -27.21 66.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.272 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.592 HD11 ' CB ' ' A' ' 66' ' ' LEU . 22.5 mt -90.9 -2.35 57.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.974 -0.29 . . . . 10.0 111.446 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.553 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.4 mt-10 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.606 -0.711 . . . . 10.0 110.038 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.561 0 C3'-C2'-C1' 101.618 -0.773 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.938 0 C3'-C2'-C1' 101.343 -0.969 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.91 0 O4'-C1'-C2' 104.187 -1.739 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.735 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 O4'-C4'-C3' 103.644 -1.956 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.637 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 O4'-C4'-C3' 103.521 -2.079 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.853 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.434 1.069 0 C5'-C4'-O4' 113.166 2.354 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.803 0 C3'-C2'-C1' 101.172 -1.091 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 101.626 -0.767 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . 0.476 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 101.793 -0.648 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.476 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.897 0 O4'-C1'-C2' 104.436 -1.513 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.749 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 O4'-C4'-C3' 103.507 -2.093 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.711 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 C4'-C3'-C2' 101.503 -1.697 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.847 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.863 0 C5'-C4'-O4' 113.032 2.27 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.953 0 C3'-C2'-C1' 100.954 -1.247 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.894 0.378 . . . . 10.0 110.572 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.78 161.83 16.47 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.85 -58.74 5.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.986 0.422 . . . . 10.0 110.291 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.12 93.48 3.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.004 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.697 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 24.0 tp -64.78 141.16 58.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -74.25 132.39 42.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.402 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 9.0 p90 -156.77 166.19 34.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.958 179.62 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.435 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.7 tp10 -154.56 129.39 9.39 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -78.11 114.68 19.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.106 0.479 . . . . 10.0 110.147 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.7 mm -85.28 -41.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.171 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -169.42 127.73 0.97 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.685 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -75.28 143.94 42.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 85.2 mt -114.78 -73.7 0.64 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.349 -0.541 . . . . 10.0 111.626 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.671 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.7 mm -129.19 143.85 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 10.0 112.315 -177.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.428 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.7 p -128.24 123.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 108.205 -1.035 . . . . 10.0 108.205 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.588 HD22 ' HB ' ' B' ' 64' ' ' VAL . 35.4 mt -91.49 -81.37 0.33 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.263 -0.575 . . . . 10.0 111.5 -178.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -177.27 -171.87 0.36 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -104.1 133.46 49.01 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -73.5 -173.72 1.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.684 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.86 -30.63 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.72 0.771 . . . . 10.0 110.31 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -83.64 -2.14 55.48 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.544 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.02 2.28 81.08 Favored Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.406 -0.902 . . . . 10.0 110.947 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 40.9 m0 -60.03 105.57 0.41 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.981 0.42 . . . . 10.0 111.191 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.3 tpp85 -82.77 100.11 10.08 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.492 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.573 ' HG2' HG22 ' A' ' 43' ' ' THR . 86.9 mttt -80.92 115.09 20.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.435 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.428 ' HG2' HG23 ' A' ' 15' ' ' VAL . 60.9 mt-10 -133.09 154.25 50.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.998 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' HB ' ' A' ' 41' ' ' ILE . 36.1 tp -125.42 107.96 11.18 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -134.9 156.72 48.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.804 0.335 . . . . 10.0 110.899 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 29' ' ' ARG . 37.6 ttm180 -90.76 114.72 27.16 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.03 -0.73 . . . . 10.0 109.03 178.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.7 m -126.03 156.54 36.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.805 0.336 . . . . 10.0 110.763 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.8 p -94.45 122.94 37.54 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.933 0.397 . . . . 10.0 110.565 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -64.42 109.47 1.95 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.049 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.0 m-80 60.33 31.04 20.29 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.67 -0.696 . . . . 10.0 110.151 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.19 17.05 10.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.548 -1.205 . . . . 10.0 111.222 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.07 -97.79 0.28 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.446 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.78 124.48 85.04 Favored Pre-proline 0 C--O 1.234 0.247 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.9 Cg_endo -80.09 123.78 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.832 2.355 . . . . 10.0 111.456 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -142.27 167.23 22.59 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.738 -0.385 . . . . 10.0 110.169 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -92.36 128.74 38.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.127 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.443 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.7 t70 -141.69 130.45 22.89 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.64 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.4 tt -106.45 122.33 60.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 110.03 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.524 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.7 mtt85 -144.87 -178.35 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.105 -177.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.573 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -127.68 142.4 51.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.817 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -117.47 175.06 5.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 10.0 109.783 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.53 159.67 71.53 Favored Pre-proline 0 C--N 1.32 -0.703 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -59.58 -28.38 87.28 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.347 2.032 . . . . 10.0 111.981 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -93.43 -5.51 49.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.126 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.12 31.61 21.43 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.563 -179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 50' ' ' LYS . 13.5 pt-20 -81.74 -40.0 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.531 -0.759 . . . . 10.0 110.927 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.418 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 44.8 mmtm -140.24 173.64 11.31 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.82 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.471 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -148.38 172.23 14.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.708 -177.755 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.643 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -130.51 -154.65 8.05 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.708 -0.758 . . . . 10.0 112.232 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -100.46 155.23 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.253 -0.557 . . . . 10.0 112.221 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.6 -120.27 1.23 Allowed Glycine 0 CA--C 1.518 0.246 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.921 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -150.52 142.66 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 117.564 0.682 . . . . 10.0 111.275 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.28 146.01 29.41 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.771 -0.65 . . . . 10.0 111.011 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.7 mt -131.55 127.18 36.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 m -80.26 171.61 14.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.699 0.285 . . . . 10.0 111.194 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -52.16 -59.43 4.38 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -59.52 -45.58 91.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.622 0.249 . . . . 10.0 111.641 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -59.86 -50.18 74.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 10.0 110.7 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.681 ' CE2' HD11 ' A' ' 66' ' ' LEU . 39.9 t80 -62.18 -41.68 98.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.397 -0.819 . . . . 10.0 111.215 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.77 57.22 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 116.069 -0.514 . . . . 10.0 112.913 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.43 -41.68 93.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.903 0.383 . . . . 10.0 110.226 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.522 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -57.31 -52.27 66.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.45 179.486 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.681 HD11 ' CE2' ' A' ' 62' ' ' PHE . 18.1 mt -62.38 -45.21 94.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.733 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -51.99 -50.13 61.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.172 -179.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 5.5 mm-40 -72.71 -46.31 54.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.664 -179.08 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 60.9 mt -58.34 -45.34 88.3 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.8 0.333 . . . . 10.0 111.575 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.38 -39.86 98.24 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 111.166 -0.774 . . . . 10.0 111.166 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 18.0 t-20 -67.22 -29.82 69.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.994 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.4 mmtt -68.12 -27.3 66.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.735 0.302 . . . . 10.0 110.731 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.586 HD11 ' HB3' ' B' ' 66' ' ' LEU . 25.5 mt -89.47 -8.45 52.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.039 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.457 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 33.4 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.62 -0.705 . . . . 10.0 110.029 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 CA-C-O 120.918 0.389 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.49 165.17 11.33 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.757 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -69.06 -58.95 3.41 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -133.42 94.71 3.36 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.667 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 28.7 tp -65.93 140.94 58.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.25 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -75.28 131.14 40.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.398 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.524 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 7.9 p90 -154.5 168.47 26.61 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.266 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.476 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.6 tp10 -155.86 128.2 7.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.8 mt -78.13 110.83 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.492 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 25.7 mm -80.92 -42.46 20.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.479 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -169.34 126.85 0.94 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.434 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -74.84 144.41 43.46 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 68.0 mt -115.8 -72.85 0.67 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.447 -0.501 . . . . 10.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.565 HD12 ' CB ' ' A' ' 68' ' ' GLU . 22.4 mm -127.86 142.93 42.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.281 0.562 . . . . 10.0 112.144 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.438 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.6 p -126.8 126.38 68.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 107.801 -1.185 . . . . 10.0 107.801 177.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 52.2 mt -93.91 -81.56 0.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.687 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.27 -172.31 0.3 Allowed 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.435 -0.579 . . . . 10.0 109.435 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -104.46 129.35 52.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -70.59 -174.92 0.95 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.998 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.83 -27.9 69.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.356 0.598 . . . . 10.0 110.841 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -88.42 0.7 55.95 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.78 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.36 2.04 83.2 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.117 -0.793 . . . . 10.0 111.117 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -60.0 105.51 0.4 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.001 0.429 . . . . 10.0 111.445 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.502 ' O ' ' HA ' ' B' ' 43' ' ' THR . 11.7 tpp85 -81.7 100.8 9.68 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.769 178.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.587 ' HG2' HG22 ' B' ' 43' ' ' THR . 82.2 mttt -81.08 116.85 21.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.625 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.438 ' HG2' HG23 ' B' ' 15' ' ' VAL . 62.9 mt-10 -135.31 152.87 51.9 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.978 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.688 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.4 tp -125.34 108.05 11.3 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -134.84 156.0 49.67 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.112 -177.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.43 ' HD2' HH11 ' B' ' 29' ' ' ARG . 39.5 ttm180 -89.59 114.57 26.18 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 m -125.78 156.41 35.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.775 0.321 . . . . 10.0 110.455 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.476 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.0 OUTLIER -94.09 124.28 38.01 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.362 179.184 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -65.16 109.66 2.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 10.0 109.934 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 60.93 30.98 19.95 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.151 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 66.36 22.07 10.85 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.801 -1.09 . . . . 10.0 110.778 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.08 -96.86 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.419 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.54 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 39.9 tt0 -78.66 122.85 85.35 Favored Pre-proline 0 C--O 1.234 0.24 0 CA-C-O 120.845 0.355 . . . . 10.0 111.854 -178.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.7 Cg_endo -79.66 124.02 5.56 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.913 2.409 . . . . 10.0 111.255 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -143.45 169.03 18.45 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.02 -0.363 . . . . 10.0 110.02 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.29 128.97 41.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.429 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -141.69 129.33 21.53 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.688 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.6 tt -105.23 122.81 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 10.0 110.084 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.524 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.0 mtt85 -145.04 -178.6 6.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.239 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.587 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -128.09 142.67 51.14 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 109.942 179.561 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -117.6 174.15 6.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.837 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.83 159.55 76.11 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.95 -26.6 82.81 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.332 2.021 . . . . 10.0 111.954 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -95.12 -5.52 43.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.037 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.84 31.35 20.72 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.538 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.444 ' HG3' ' N ' ' B' ' 50' ' ' LYS . 11.5 pt-20 -81.49 -39.76 24.28 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.893 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 50' ' ' LYS . . . . . 0.444 ' N ' ' HG3' ' B' ' 49' ' ' GLU . 39.1 mmtm -139.43 173.05 11.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.808 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.469 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -146.78 172.38 13.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.524 -177.975 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.62 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -131.17 -154.69 7.94 Favored Glycine 0 C--O 1.228 -0.278 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.34 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 53' ' ' LYS . . . . . 0.403 ' HA ' ' NH2' ' B' ' 42' ' ' ARG . 42.1 mttp -101.08 150.49 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 122.298 -0.531 . . . . 10.0 112.264 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.51 -123.14 1.88 Allowed Glycine 0 C--N 1.332 0.311 0 N-CA-C 110.595 -1.002 . . . . 10.0 110.595 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -147.93 142.59 19.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 117.653 0.726 . . . . 10.0 111.065 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 140.76 37.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.338 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 52.4 mt -126.2 126.79 44.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.095 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m -78.68 173.86 12.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.831 0.348 . . . . 10.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -57.16 -56.73 18.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.105 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.562 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.7 pt-20 -61.16 -44.17 97.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.651 0.262 . . . . 10.0 111.494 -179.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -62.77 -48.05 80.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.015 0.436 . . . . 10.0 110.749 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -64.64 -38.58 91.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.436 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.84 -53.66 44.42 Favored Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.117 -0.492 . . . . 10.0 112.549 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.588 ' HB ' HD22 ' A' ' 16' ' ' LEU . 20.5 t -61.42 -43.33 96.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 10.0 110.047 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.4 tp -57.26 -52.48 65.15 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.615 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.586 ' HB3' HD11 ' A' ' 73' ' ' LEU . 80.9 mt -59.32 -51.51 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.18 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.1 tttm -48.52 -52.09 24.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.873 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.671 ' HB3' HD12 ' A' ' 14' ' ' ILE . 14.5 mm-40 -71.15 -48.12 53.78 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.951 -178.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.681 ' HB3' HD22 ' A' ' 66' ' ' LEU . 55.9 mt -58.89 -44.55 91.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.98 -41.11 99.64 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.924 -0.87 . . . . 10.0 110.924 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 12.0 t-20 -67.08 -30.0 69.92 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.909 0.385 . . . . 10.0 111.258 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.604 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.7 mmtt -65.13 -31.34 72.48 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.312 -0.242 . . . . 10.0 111.146 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.536 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.5 mt -90.12 -5.85 56.06 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.718 -0.393 . . . . 10.0 111.642 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.457 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 28.1 mt-10 . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.622 -0.704 . . . . 10.0 110.47 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.513 -0.574 0 C3'-C2'-C1' 101.425 -0.91 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . 0.5 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 C3'-C2'-C1' 101.538 -0.83 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . 0.5 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.887 0 O4'-C1'-C2' 104.143 -1.779 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.697 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O4'--C1' 1.429 0.718 0 O4'-C4'-C3' 103.58 -2.02 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.524 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.904 0 O4'-C4'-C3' 103.52 -2.08 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.854 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.776 0 C5'-C4'-O4' 113.145 2.34 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.907 0 C3'-C2'-C1' 101.302 -0.998 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.914 0 C3'-C2'-C1' 101.45 -0.893 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.844 0 C5'-C4'-O4' 108.567 -0.52 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.451 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C1'-C2' 104.277 -1.657 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.667 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.835 0 O4'-C4'-C3' 103.585 -2.015 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.524 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 O4'-C4'-C3' 103.752 -1.848 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.797 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.953 0 C5'-C4'-O4' 113.036 2.273 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.54 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.424 -0.978 0 C3'-C2'-C1' 100.969 -1.236 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.941 0.4 . . . . 10.0 110.177 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.76 162.53 13.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.9 -53.0 14.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -133.93 94.8 3.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.006 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.802 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 21.9 tp -67.73 144.4 55.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.605 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -77.58 133.4 38.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.701 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -161.1 172.91 15.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.479 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.6 133.96 11.65 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.42 ' HA ' HG12 ' A' ' 30' ' ' VAL . 65.1 mt -83.8 107.9 15.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 120.985 0.421 . . . . 10.0 110.031 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.2 mm -76.0 -45.85 35.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -165.23 131.18 2.7 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.632 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.21 144.63 34.22 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 83.1 mt -113.7 -74.63 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.279 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.681 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.0 mm -132.1 139.15 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.246 0.546 . . . . 10.0 112.171 -177.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -120.17 122.21 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.851 -1.166 . . . . 10.0 107.851 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.489 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.0 mt -89.03 -80.67 0.29 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.533 -0.467 . . . . 10.0 111.917 -177.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 m 179.2 -169.41 0.1 Allowed 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.414 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 32.9 mp0 -106.45 146.27 30.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.263 179.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -87.86 -170.39 2.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.27 -24.56 67.7 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.532 0.682 . . . . 10.0 110.71 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HD3' H2'' ' C' ' 1' ' ' ' DT' . 31.1 mttt -93.9 3.28 55.61 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.061 -0.972 . . . . 10.0 110.757 -179.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.75 8.08 86.47 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.8 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.414 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -60.82 103.97 0.31 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.755 0.312 . . . . 10.0 111.5 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.513 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.1 tpp85 -81.58 99.26 8.74 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.469 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.6 mttt -85.37 117.82 24.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.918 0.39 . . . . 10.0 110.612 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG2' HG23 ' A' ' 15' ' ' VAL . 48.6 mt-10 -135.12 153.71 51.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.529 -0.759 . . . . 10.0 111.123 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.544 HD13 ' HB ' ' A' ' 41' ' ' ILE . 34.9 tp -123.16 107.23 11.5 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -135.79 154.96 51.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.315 -178.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -91.24 115.05 27.71 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.5 m -123.85 160.43 27.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.696 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.479 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -97.29 122.83 40.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.349 179.059 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.5 m0 -63.64 110.97 2.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.898 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.457 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 58.36 30.29 19.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.41 0.624 . . . . 10.0 110.18 -178.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.9 t70 62.53 29.64 17.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.802 -1.09 . . . . 10.0 111.028 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.7 -74.98 0.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 O-C-N 122.103 -0.373 . . . . 10.0 111.49 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.51 112.69 50.04 Favored Pre-proline 0 C--N 1.328 -0.357 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.422 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.8 Cg_endo -80.45 120.18 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.392 2.061 . . . . 10.0 110.714 178.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttpt -152.35 172.22 16.8 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.843 -0.343 . . . . 10.0 110.482 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -91.06 134.94 34.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.675 0.274 . . . . 10.0 111.262 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -146.88 130.45 16.85 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.544 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.6 tt -107.14 123.45 62.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.283 0.563 . . . . 10.0 110.194 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.464 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.1 mtt85 -146.32 179.28 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.34 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.513 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -126.82 145.11 50.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.147 179.668 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -117.4 173.5 6.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.457 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -76.69 156.57 82.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.17 -33.08 95.24 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.396 2.064 . . . . 10.0 112.943 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -97.27 2.85 51.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.811 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 56.99 41.68 27.31 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.266 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.78 -37.21 14.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.622 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -142.21 174.36 10.68 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.019 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.461 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -136.68 172.43 13.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.458 -0.792 . . . . 10.0 111.234 -177.614 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.631 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -134.74 -165.89 10.98 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 121.182 -0.533 . . . . 10.0 111.917 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.6 mttp -94.53 156.16 16.58 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.024 -0.692 . . . . 10.0 111.988 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.4 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.67 -130.76 1.76 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.017 -0.833 . . . . 10.0 111.017 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 tt -144.23 143.72 23.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 117.723 0.761 . . . . 10.0 111.44 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.73 144.2 31.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.966 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -125.01 131.53 53.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.379 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.94 162.92 25.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.553 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.9 -51.7 66.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -178.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.06 -44.68 97.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.777 0.323 . . . . 10.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.452 ' HB3' HD13 ' B' ' 16' ' ' LEU . 79.8 mt-10 -62.19 -45.72 92.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.448 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.685 ' CE2' HD11 ' A' ' 66' ' ' LEU . 29.2 t80 -61.39 -42.61 99.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.019 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.48 -53.76 43.46 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.394 -0.432 . . . . 10.0 112.457 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.5 t -59.97 -41.63 86.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.986 0.422 . . . . 10.0 110.262 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.1 tp -59.97 -53.98 51.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.713 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.685 HD11 ' CE2' ' A' ' 62' ' ' PHE . 17.3 mt -60.89 -46.88 88.88 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.637 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.6 tttm -49.93 -55.28 15.06 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.735 0.647 . . . . 10.0 111.43 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.493 ' CB ' HD12 ' B' ' 14' ' ' ILE . 26.2 mm-40 -68.9 -45.45 70.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.736 -0.666 . . . . 10.0 111.788 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 67.4 mt -59.17 -45.41 91.08 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.898 0.38 . . . . 10.0 111.434 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.78 -36.74 93.77 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.932 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.413 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 6.8 t-20 -74.37 -28.48 61.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.807 0.337 . . . . 10.0 110.919 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.6 mmtt -66.86 -28.43 68.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.898 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.553 HD11 ' HB3' ' B' ' 66' ' ' LEU . 31.4 mt -85.4 -2.38 58.04 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.773 0.286 . . . . 10.0 111.773 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.413 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 46.9 mt-10 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.507 -0.759 . . . . 10.0 110.831 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 120.881 0.372 . . . . 10.0 110.116 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.28 163.17 13.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -75.54 -47.91 24.77 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -136.9 94.0 2.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.832 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.797 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 25.9 tp -67.64 143.05 56.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.592 179.4 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.517 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.7 tppt? -78.16 131.7 37.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.649 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.651 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.3 p90 -159.49 174.43 14.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.843 179.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -156.56 133.19 10.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.411 ' HA ' HG12 ' B' ' 30' ' ' VAL . 54.3 mt -83.59 104.17 11.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.16 0.505 . . . . 10.0 110.582 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.5 mm -71.8 -50.29 39.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.504 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -159.99 128.19 4.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.232 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -75.54 145.46 41.25 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 93.6 mt -116.61 -70.94 0.76 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.248 -0.581 . . . . 10.0 111.892 -179.369 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.493 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.2 mm -133.46 140.4 46.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.09 0.472 . . . . 10.0 111.654 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.88 119.82 57.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 107.589 -1.263 . . . . 10.0 107.589 177.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' LEU . . . . . 0.452 HD13 ' HB3' ' A' ' 61' ' ' GLU . 35.5 mt -86.51 -81.42 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.453 -0.499 . . . . 10.0 111.971 -177.435 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.54 -168.5 0.15 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.459 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 30.1 mp0 -108.97 142.06 40.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 178.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -82.57 -169.72 2.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.908 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.84 65.75 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.326 0.584 . . . . 10.0 111.012 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' LYS . . . . . 0.451 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 24.8 mttt -94.35 4.24 54.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.088 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.85 5.86 88.97 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.752 -0.737 . . . . 10.0 111.823 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.459 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -59.36 106.1 0.41 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.726 0.298 . . . . 10.0 111.452 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -83.58 99.76 10.38 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.491 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.5 mttt -84.95 117.71 24.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 110.818 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -134.76 154.05 51.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.949 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.658 HD13 ' HB ' ' B' ' 41' ' ' ILE . 46.7 tp -123.96 107.41 11.31 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 178.058 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -135.52 152.54 51.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.175 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -88.83 114.47 25.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' B' ' 9' ' ' ILE . 11.3 m -123.07 161.63 24.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.661 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.51 123.94 41.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.89 0.376 . . . . 10.0 110.246 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -64.07 109.4 1.81 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.839 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.7 m-80 59.46 30.23 19.88 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.109 -178.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.6 t70 63.53 29.55 15.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.994 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -122.58 -71.76 0.71 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.491 -0.322 . . . . 10.0 111.786 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -89.18 112.58 52.0 Favored Pre-proline 0 C--N 1.329 -0.316 0 N-CA-C 111.887 0.328 . . . . 10.0 111.887 -178.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -79.8 119.65 4.07 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.017 1.811 . . . . 10.0 110.562 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -151.42 173.5 14.48 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.719 -0.392 . . . . 10.0 110.171 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -93.28 135.52 34.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.57 0.224 . . . . 10.0 111.159 -179.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -147.44 129.81 15.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.658 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.8 tt -105.7 123.29 60.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.247 0.546 . . . . 10.0 110.115 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.515 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.5 mtt85 -146.11 178.75 7.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.418 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.499 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -126.16 145.15 50.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.984 179.957 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -117.76 174.13 6.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.186 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 156.26 82.38 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 178.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.77 -36.42 98.55 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.433 2.088 . . . . 10.0 112.662 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.34 1.81 56.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.028 0.442 . . . . 10.0 110.697 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.59 44.99 20.03 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.11 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -93.5 -37.55 11.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.622 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -140.25 173.4 11.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.333 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.512 ' O ' " H1'" ' C' ' 13' ' ' ' DT' . 0.0 OUTLIER -135.86 170.74 15.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.985 -1.007 . . . . 10.0 110.819 -178.057 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.604 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -133.54 -165.95 11.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.127 -0.559 . . . . 10.0 111.762 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.6 151.94 18.91 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.139 -0.624 . . . . 10.0 111.872 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.413 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -146.58 -133.13 2.43 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.176 -0.92 . . . . 10.0 110.83 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -142.22 145.36 23.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 117.498 0.649 . . . . 10.0 111.478 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -103.55 144.92 30.78 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.353 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.51 130.28 51.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.244 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -77.95 163.43 25.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -56.62 -52.73 63.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.542 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.8 pt-20 -58.98 -44.37 91.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 10.0 111.157 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -63.95 -45.37 89.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.706 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.457 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.9 t80 -63.21 -39.69 95.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.328 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.87 -52.39 53.22 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.304 179.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 60' ' ' GLU . 21.5 t -60.87 -43.97 96.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.088 0.471 . . . . 10.0 109.933 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.93 -55.53 33.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.917 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.553 ' HB3' HD11 ' A' ' 73' ' ' LEU . 52.5 mt -57.98 -50.74 72.34 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.354 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -49.38 -55.13 13.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.022 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.681 ' HB3' HD12 ' A' ' 14' ' ' ILE . 36.6 mm-40 -69.05 -45.85 69.33 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.88 -178.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.66 ' HB3' HD22 ' A' ' 66' ' ' LEU . 71.7 mt -60.88 -44.23 97.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.813 0.339 . . . . 10.0 111.648 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.32 -37.53 94.74 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.735 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 71' ' ' ASN . . . . . 0.485 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.3 t-20 -73.3 -31.47 64.05 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.843 0.354 . . . . 10.0 110.765 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.3 mmtt -64.09 -25.88 68.3 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.55 0.574 . . . . 10.0 112.55 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.653 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.0 mt -90.42 4.94 49.53 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.829 -0.348 . . . . 10.0 111.689 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.485 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.7 mt-10 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.325 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . 0.458 H2'' ' HD3' ' A' ' 21' ' ' LYS . . . . . . . . 0 C2'--C1' 1.512 -0.635 0 C3'-C2'-C1' 101.599 -0.786 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . 0.515 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.892 0 C3'-C2'-C1' 101.487 -0.866 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . 0.515 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.967 0 O4'-C1'-C2' 104.089 -1.828 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.802 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 O4'-C4'-C3' 103.508 -2.092 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.626 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C4'-C3' 103.517 -2.083 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.872 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.433 0.963 0 C5'-C4'-O4' 113.123 2.327 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 C3'-C2'-C1' 101.052 -1.177 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . 0.451 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 C3'-C2'-C1' 101.471 -0.878 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . 0.483 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.926 0 C3'-C2'-C1' 101.767 -0.666 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.512 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 O4'-C1'-C2' 104.432 -1.517 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.797 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 O4'-C4'-C3' 103.498 -2.102 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.708 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.423 -1.055 0 O4'-C4'-C3' 103.71 -1.89 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.882 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.433 0.963 0 C5'-C4'-O4' 113.203 2.377 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.831 0 C3'-C2'-C1' 101.061 -1.17 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 CA-C-O 120.845 0.355 . . . . 10.0 110.558 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.64 168.53 9.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.194 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -64.74 -58.35 6.49 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -136.75 110.69 8.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.066 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.857 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 26.0 tp -80.38 133.12 35.87 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 178.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.431 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.0 tppt? -67.65 133.79 49.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.829 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.505 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 15.8 p90 -158.1 168.03 28.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.42 . . . . 10.0 109.919 179.265 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 12.3 tp10 -149.19 125.54 10.86 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.886 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 30' ' ' VAL . 61.4 mt -79.31 106.08 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.55 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.6 mm -72.06 -46.08 60.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.01 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.81 132.57 1.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.651 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -75.93 145.12 40.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.969 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 79.5 mt -112.65 -74.79 0.62 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.662 -0.415 . . . . 10.0 111.635 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.682 HD12 ' HB3' ' B' ' 68' ' ' GLU . 30.6 mm -132.37 137.37 54.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.767 0.655 . . . . 10.0 112.767 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.417 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.0 p -118.85 125.36 74.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.504 HD22 ' HB ' ' B' ' 64' ' ' VAL . 30.1 mt -94.18 -81.32 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 10.0 112.073 -177.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.0 m -172.88 -168.36 0.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.77 -0.456 . . . . 10.0 109.77 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.515 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 2.2 mp0 -112.37 135.06 53.52 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -73.27 -173.67 1.4 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.75 0.31 . . . . 10.0 110.728 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.82 -20.79 66.59 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.611 0.72 . . . . 10.0 109.896 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -91.1 -1.81 57.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.767 -1.106 . . . . 10.0 110.522 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 1.19 85.99 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.987 -0.845 . . . . 10.0 110.987 -178.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.515 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.2 m0 -60.27 108.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.82 0.343 . . . . 10.0 111.606 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' A' ' 43' ' ' THR . 6.8 tpp85 -86.93 99.61 11.99 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.407 178.545 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.625 ' HG2' HG22 ' A' ' 43' ' ' THR . 86.2 mttt -83.05 118.54 23.6 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.07 0.462 . . . . 10.0 110.587 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.417 ' HG2' HG23 ' A' ' 15' ' ' VAL . 60.1 mt-10 -133.52 145.17 49.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.853 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.716 HD13 ' HB ' ' A' ' 41' ' ' ILE . 40.7 tp -115.38 107.86 15.77 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -133.77 159.1 41.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.933 0.397 . . . . 10.0 110.958 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -94.08 114.09 26.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 9' ' ' ILE . 17.1 m -127.31 158.77 38.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.896 0.379 . . . . 10.0 110.821 -179.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.495 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -98.41 125.53 43.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.958 0.409 . . . . 10.0 110.475 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -64.23 108.95 1.71 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.843 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 61.19 25.66 15.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.027 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.9 t70 66.89 21.81 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.794 -1.093 . . . . 10.0 110.437 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.12 -75.92 0.61 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.281 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -98.89 120.74 57.94 Favored Pre-proline 0 C--N 1.329 -0.292 0 N-CA-C 111.776 0.287 . . . . 10.0 111.776 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.3 Cg_endo -79.45 120.81 4.53 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.861 2.374 . . . . 10.0 111.477 178.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.9 ttmm -143.52 168.49 19.74 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -92.02 129.5 37.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.596 0.236 . . . . 10.0 110.694 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.451 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -141.83 132.46 25.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.716 ' HB ' HD13 ' A' ' 27' ' ' LEU . 8.8 tt -110.78 121.21 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.239 0.542 . . . . 10.0 110.048 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.525 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.8 mtt85 -143.23 -178.74 6.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.446 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.625 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -125.61 143.02 51.21 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.125 179.5 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -117.91 169.31 9.74 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.664 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.18 156.46 87.99 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.347 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.62 -27.81 84.04 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.267 1.978 . . . . 10.0 112.048 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -94.75 -0.86 53.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.817 -0.628 . . . . 10.0 110.417 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 58.71 31.37 21.09 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.718 -0.673 . . . . 10.0 111.004 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -82.08 -36.41 27.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.895 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -137.8 175.22 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.359 0.599 . . . . 10.0 111.332 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.429 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -135.1 172.21 13.33 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.86 -1.064 . . . . 10.0 110.558 -178.091 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.664 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.08 -164.9 10.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.971 -0.633 . . . . 10.0 112.157 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -96.31 151.74 19.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.937 -0.743 . . . . 10.0 112.073 -179.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.26 -126.98 1.53 Allowed Glycine 0 C--N 1.332 0.349 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.21 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 tt -142.98 145.06 23.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-N 117.599 0.7 . . . . 10.0 111.453 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.481 ' HB ' ' H71' ' C' ' 7' ' ' ' DT' . 1.0 OUTLIER -107.7 139.96 41.48 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.886 179.782 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 36.7 mt -124.19 132.31 53.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.889 0.376 . . . . 10.0 110.275 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 m -76.56 164.55 25.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.934 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -60.82 -44.04 97.43 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.701 0.259 . . . . 10.0 111.701 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -60.43 -47.29 86.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.197 0.522 . . . . 10.0 110.708 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.573 ' HB3' HD13 ' B' ' 16' ' ' LEU . 38.6 mt-10 -64.03 -45.2 89.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.597 179.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.721 ' CE2' HD11 ' A' ' 66' ' ' LEU . 20.3 t80 -58.25 -44.45 88.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.329 -0.85 . . . . 10.0 111.005 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.54 -52.72 51.45 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.312 -0.47 . . . . 10.0 112.379 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.5 t -61.9 -42.85 96.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 120.969 0.414 . . . . 10.0 110.587 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.548 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.8 tp -57.42 -55.65 32.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.584 -0.735 . . . . 10.0 110.932 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.721 HD11 ' CE2' ' A' ' 62' ' ' PHE . 20.3 mt -63.25 -43.03 99.17 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.007 -0.277 . . . . 10.0 111.614 -179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.3 ttpp -51.56 -51.54 54.52 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.424 0.453 . . . . 10.0 111.189 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.549 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 32.8 mm-40 -71.89 -44.18 64.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.394 -179.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 73.2 mt -58.8 -45.31 90.19 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.26 94.54 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.6 -0.809 . . . . 10.0 111.092 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.25 -29.69 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 10.0 110.591 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 34.3 mmtt -68.67 -25.25 64.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.22 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.572 HD11 ' HB3' ' B' ' 66' ' ' LEU . 37.4 mt -89.55 -0.79 57.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.666 -179.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.138 -0.934 . . . . 10.0 111.019 -179.216 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.03 0.443 . . . . 10.0 110.553 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.98 164.78 11.69 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -62.57 -58.26 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.464 0.649 . . . . 10.0 109.449 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -134.15 112.92 11.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.056 -0.975 . . . . 10.0 109.36 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.796 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 32.2 tp -82.33 133.95 35.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.6 tppt? -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.948 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.571 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 12.5 p90 -155.48 163.84 39.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.254 -0.43 . . . . 10.0 109.842 179.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.488 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.5 tp10 -145.97 126.49 14.14 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.597 -0.52 . . . . 10.0 109.597 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.484 ' HA ' HG12 ' B' ' 30' ' ' VAL . 39.5 mt -79.6 108.78 13.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.453 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -74.86 -45.1 44.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.874 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -170.15 134.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.655 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -76.89 144.56 38.85 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.616 179.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 76.2 mt -113.76 -72.21 0.71 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.449 -0.5 . . . . 10.0 112.08 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.447 HD12 ' CB ' ' A' ' 68' ' ' GLU . 13.2 mm -131.52 139.15 51.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.038 0.447 . . . . 10.0 111.996 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 p -122.83 123.89 69.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.665 -1.235 . . . . 10.0 107.665 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' LEU . . . . . 0.573 HD13 ' HB3' ' A' ' 61' ' ' GLU . 41.4 mt -93.38 -82.06 0.35 Allowed 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.045 -0.662 . . . . 10.0 112.023 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.6 m -174.19 -167.9 0.36 Allowed 'General case' 0 C--O 1.236 0.388 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.517 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 2.0 mp0 -111.87 134.99 53.07 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 10.0 109.916 178.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -72.73 -175.87 1.82 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.51 66.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.518 0.675 . . . . 10.0 110.211 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -89.7 -3.49 58.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.265 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.94 3.37 79.95 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.234 -0.746 . . . . 10.0 111.234 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.517 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -61.59 108.58 1.0 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.686 0.279 . . . . 10.0 111.483 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' B' ' 43' ' ' THR . 5.5 tpp85 -86.49 99.97 12.04 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.351 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' B' ' 43' ' ' THR . 86.8 mttt -83.18 118.6 23.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.933 0.397 . . . . 10.0 110.761 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -133.91 144.48 48.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.748 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.692 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.9 tp -114.87 107.82 15.93 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -133.76 160.22 38.25 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.984 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' B' ' 29' ' ' ARG . 20.8 ttm180 -95.52 114.23 25.97 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.484 HG12 ' HA ' ' B' ' 9' ' ' ILE . 17.8 m -127.1 158.03 38.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.985 0.421 . . . . 10.0 110.587 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.2 p -97.35 126.05 42.34 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.032 0.444 . . . . 10.0 110.494 179.195 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -64.21 108.71 1.64 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.492 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.5 m-80 60.34 26.43 15.95 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.836 0.71 . . . . 10.0 110.267 -178.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 67.25 22.29 9.69 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.046 -0.979 . . . . 10.0 110.922 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.41 -75.35 0.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.062 -0.399 . . . . 10.0 111.429 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.675 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 33.5 tt0 -98.86 118.78 62.38 Favored Pre-proline 0 C--N 1.33 -0.264 0 N-CA-C 111.71 0.263 . . . . 10.0 111.71 -178.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 61.7 Cg_endo -77.89 120.77 5.18 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.781 2.32 . . . . 10.0 111.514 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.43 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 21.1 ttmm -143.1 169.98 16.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' TYR . . . . . 0.43 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 22.4 m-85 -93.55 128.95 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.716 0.293 . . . . 10.0 110.556 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -141.43 132.39 26.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.692 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.5 tt -110.71 122.07 64.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.257 0.551 . . . . 10.0 110.013 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.488 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 2.7 mtt85 -144.18 -179.74 6.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.209 -177.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.581 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.17 143.41 50.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.138 179.853 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -117.82 171.37 8.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.022 -0.536 . . . . 10.0 109.664 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -68.44 157.04 89.12 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -22.15 70.45 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.414 2.076 . . . . 10.0 111.859 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -100.72 0.07 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.13 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 58.34 30.05 19.02 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.075 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.1 -39.96 28.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.094 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -135.44 174.5 10.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 10.0 111.516 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.412 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -134.57 172.47 12.88 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.949 -1.023 . . . . 10.0 110.533 -178.29 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.686 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.34 -161.95 9.01 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.127 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -99.44 147.08 25.65 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.989 -0.713 . . . . 10.0 112.142 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.431 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -141.98 -124.44 1.96 Allowed Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.144 -0.934 . . . . 10.0 110.777 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -145.82 146.46 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 117.556 0.678 . . . . 10.0 110.807 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.9 m -107.79 139.89 41.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.197 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.3 mt -124.25 132.29 53.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.234 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.23 166.78 22.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.179 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.26 -40.78 96.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.677 -0.238 . . . . 10.0 111.288 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.516 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.4 pt-20 -63.76 -44.74 92.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.421 . . . . 10.0 110.511 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.445 ' OE2' ' HD2' ' A' ' 25' ' ' LYS . 36.1 mt-10 -66.47 -46.85 74.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.608 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.451 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.5 t80 -58.23 -39.26 78.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.438 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.61 -49.72 75.47 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.203 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 60' ' ' GLU . 8.2 t -66.5 -43.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.044 0.449 . . . . 10.0 110.432 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.3 tp -56.27 -54.73 41.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.887 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.572 ' HB3' HD11 ' A' ' 73' ' ' LEU . 48.9 mt -61.19 -47.82 84.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.126 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -50.49 -53.59 28.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.689 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.682 ' HB3' HD12 ' A' ' 14' ' ' ILE . 27.8 mm-40 -69.5 -47.17 64.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.844 -178.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.501 ' HB3' HD22 ' A' ' 66' ' ' LEU . 70.6 mt -60.13 -41.2 92.18 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.752 0.279 . . . . 10.0 111.752 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.21 -36.27 92.65 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.603 -0.808 . . . . 10.0 111.267 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -74.05 -29.66 62.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.077 0.465 . . . . 10.0 110.775 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 38.6 mmtt -65.56 -26.45 67.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.611 HD11 ' CB ' ' A' ' 66' ' ' LEU . 27.0 mt -89.44 3.24 52.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.694 0.283 . . . . 10.0 111.558 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.254 1.29 0 CA-C-O 118.567 -0.73 . . . . 10.0 110.105 179.694 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O5'-C5'-C4' 109.13 -0.764 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.717 0 C3'-C2'-C1' 101.363 -0.955 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.954 0 C1'-O4'-C4' 107.315 -1.704 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.857 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.519 -0.897 0 O4'-C4'-C3' 103.506 -2.094 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.48 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 O4'-C4'-C3' 103.373 -2.227 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.813 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.9 0 C5'-C4'-O4' 113.044 2.278 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . 0.481 ' H71' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C3'-C2'-C1' 101.482 -0.87 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 C3'-C2'-C1' 101.612 -0.777 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 C3'-C2'-C1' 101.723 -0.698 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.422 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.843 0 O4'-C1'-C2' 104.528 -1.429 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.796 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O4'-C4'-C3' 103.433 -2.167 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.488 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.829 0 O4'-C4'-C3' 103.502 -2.098 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.802 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.429 0.67 0 C5'-C4'-O4' 113.034 2.271 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.675 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 C3'-C2'-C1' 100.525 -1.554 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.8 mtm . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 120.879 0.371 . . . . 10.0 110.539 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.12 160.29 14.39 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.416 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 13.0 t70 -62.19 -57.32 11.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 39.1 mmtm -138.29 94.29 2.85 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.851 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 26.5 tp -64.7 137.8 58.02 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.6 tppt? -71.75 134.29 46.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.148 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.446 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 13.0 p90 -159.58 170.12 22.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.006 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.444 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.13 133.52 11.81 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.285 -0.416 . . . . 10.0 109.938 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 70.7 mt -80.74 110.48 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.107 0.479 . . . . 10.0 110.418 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.426 HG13 ' HB3' ' A' ' 37' ' ' PRO . 33.4 mm -82.8 -39.61 15.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.215 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -167.3 139.35 3.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.841 -179.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.15 137.08 32.93 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 53.1 mt -104.55 -76.01 0.61 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.488 -0.485 . . . . 10.0 110.828 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.796 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.6 mm -134.92 134.22 53.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.222 0.534 . . . . 10.0 111.848 -178.147 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.418 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -114.63 121.93 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 177.25 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' B' ' 61' ' ' GLU . 32.0 mt -89.38 -80.67 0.3 Allowed 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.496 -0.482 . . . . 10.0 111.837 -177.515 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.2 m -179.64 -168.57 0.12 Allowed 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.293 0.371 . . . . 10.0 110.058 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.1 mp0 -110.49 146.33 36.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.402 ' CG ' ' H ' ' A' ' 20' ' ' ALA . 11.9 t-20 -89.55 -168.82 2.27 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.132 -0.692 . . . . 10.0 109.132 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.402 ' H ' ' CG ' ' A' ' 19' ' ' ASN . . . -64.28 -26.42 68.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.481 0.658 . . . . 10.0 111.006 -178.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -85.94 -0.14 54.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.218 -0.901 . . . . 10.0 110.837 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.25 2.98 90.37 Favored Glycine 0 N--CA 1.444 -0.773 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -58.56 108.89 0.69 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 111.467 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.5 tpp85 -79.96 108.93 13.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.17 178.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.564 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 61.5 mttt -88.89 109.82 20.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.194 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.418 ' HG2' HG23 ' A' ' 15' ' ' VAL . 48.2 mt-10 -133.28 149.3 51.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.627 0.727 . . . . 10.0 112.412 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.853 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.4 tp -122.36 108.54 13.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.518 -1.219 . . . . 10.0 107.882 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -134.16 166.28 23.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.304 0.574 . . . . 10.0 111.961 -177.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 29' ' ' ARG . 6.3 ttm180 -98.71 114.33 26.8 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.6 m -128.71 156.83 41.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.761 0.315 . . . . 10.0 110.651 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.444 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.8 OUTLIER -93.51 123.91 37.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.252 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -64.4 108.82 1.73 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.784 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.404 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 60.74 30.3 19.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.932 -178.126 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t0 66.29 18.77 10.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.669 -1.151 . . . . 10.0 111.206 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.26 -93.1 0.28 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.599 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -84.94 126.59 67.61 Favored Pre-proline 0 C--O 1.233 0.22 0 CA-C-O 120.582 0.23 . . . . 10.0 111.593 -179.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.426 ' HB3' HG13 ' A' ' 10' ' ' ILE . 71.6 Cg_endo -81.0 120.42 3.76 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.042 2.495 . . . . 10.0 111.818 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -139.36 167.04 22.97 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -92.52 129.93 38.32 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.506 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t0 -139.88 132.94 29.53 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.892 -0.411 . . . . 10.0 109.892 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.853 ' HB ' HD13 ' A' ' 27' ' ' LEU . 13.7 tt -109.33 122.01 63.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.55 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtt85 -144.91 170.87 15.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.508 0.67 . . . . 10.0 112.103 -177.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.564 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.32 131.49 55.93 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 114.881 -1.054 . . . . 10.0 110.205 179.458 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -117.43 176.7 5.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.255 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.88 156.71 84.31 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -55.3 -37.5 94.47 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.729 2.286 . . . . 10.0 112.557 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -94.22 3.57 55.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.239 0.542 . . . . 10.0 110.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.8 m170 61.09 26.32 16.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.618 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.18 -35.06 77.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.728 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 50' ' ' LYS . 36.4 mmtm -141.76 174.42 10.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.533 . . . . 10.0 111.291 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.88 172.29 11.84 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.457 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.522 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.93 -175.28 14.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.813 -0.708 . . . . 10.0 112.461 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -91.85 139.03 31.06 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.427 -0.455 . . . . 10.0 111.901 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.4 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -138.77 -121.2 1.9 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.369 -0.832 . . . . 10.0 111.174 179.166 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.3 tt -150.67 143.73 17.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.335 0.568 . . . . 10.0 111.012 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -104.39 135.59 45.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.53 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.8 mt -113.9 121.99 45.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.58 176.92 9.26 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.8 -0.36 . . . . 10.0 110.448 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.78 -41.5 91.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.192 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.495 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 13.4 pt-20 -56.14 -47.88 77.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.336 0.589 . . . . 10.0 110.739 178.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.495 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 30.1 mt-10 -67.16 -60.18 2.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.329 -0.851 . . . . 10.0 111.663 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.621 ' CE2' HD11 ' A' ' 66' ' ' LEU . 5.1 t80 -48.29 -45.11 34.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.235 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.69 34.85 Favored Glycine 0 C--O 1.237 0.313 0 C-N-CA 121.389 -0.434 . . . . 10.0 113.264 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.9 t -69.58 -43.62 80.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.736 0.303 . . . . 10.0 111.419 -179.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.96 -52.45 65.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.431 -178.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.628 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.3 mt -62.93 -46.15 89.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 120.788 -0.365 . . . . 10.0 111.465 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -52.32 -50.42 62.29 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.598 0.562 . . . . 10.0 110.906 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.658 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 34.6 mm-40 -70.55 -50.15 40.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.813 -0.631 . . . . 10.0 111.947 -179.045 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 mt -55.89 -47.49 77.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.574 0.226 . . . . 10.0 111.58 -179.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.93 -31.22 80.21 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.601 -0.809 . . . . 10.0 111.592 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -74.37 -32.85 62.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.64 0.257 . . . . 10.0 111.116 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.658 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 33.3 mmtt -70.22 -24.24 63.06 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.71 0.29 . . . . 10.0 110.971 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' B' ' 66' ' ' LEU . 22.5 mt -85.05 -6.46 59.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.113 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.442 -0.79 . . . . 10.0 110.634 -179.542 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.871 0.367 . . . . 10.0 110.23 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.82 163.82 14.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -68.93 -55.12 11.98 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -137.94 93.24 2.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.934 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.83 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 34.6 tp -63.91 139.82 58.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.376 . . . . 10.0 110.656 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -74.33 134.88 42.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.852 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.594 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 11.9 p90 -161.31 171.31 18.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.491 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -156.48 131.59 9.18 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -78.53 108.61 12.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.239 0.543 . . . . 10.0 110.534 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' B' ' 37' ' ' PRO . 24.5 mm -80.8 -40.52 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.936 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -166.79 138.91 3.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.621 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -84.22 139.63 32.23 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.4 mt -108.05 -73.42 0.69 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.433 -0.507 . . . . 10.0 111.274 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.589 HD12 ' HB3' ' A' ' 68' ' ' GLU . 14.7 mm -136.13 132.62 50.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.815 0.34 . . . . 10.0 111.761 -178.16 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.441 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -114.05 122.29 67.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 107.578 -1.268 . . . . 10.0 107.578 176.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.7 mt -88.31 -81.13 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.429 -0.509 . . . . 10.0 111.83 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 179.06 -169.21 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.543 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 11.5 mp0 -109.56 145.68 35.94 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.072 -0.344 . . . . 10.0 110.072 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -88.09 -168.28 2.16 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.62 -22.27 66.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.192 0.52 . . . . 10.0 111.155 -179.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -91.02 1.8 56.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 0.95 90.08 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.111 -0.796 . . . . 10.0 111.111 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -56.53 109.39 0.61 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.576 -0.312 . . . . 10.0 111.697 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.3 tpp85 -80.03 110.63 15.6 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.525 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 61.0 mttt -90.04 110.86 21.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.394 -179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.441 ' HG2' HG23 ' B' ' 15' ' ' VAL . 48.1 mt-10 -134.74 150.37 50.56 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.627 0.727 . . . . 10.0 112.333 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.81 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.3 tp -123.97 108.9 12.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.556 -1.202 . . . . 10.0 108.006 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -134.25 166.59 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.18 0.514 . . . . 10.0 111.828 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' B' ' 29' ' ' ARG . 7.2 ttm180 -98.05 113.75 25.72 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.32 -0.992 . . . . 10.0 108.32 178.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.5 m -128.74 155.46 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.887 0.375 . . . . 10.0 110.735 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -93.05 124.89 37.34 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.922 0.391 . . . . 10.0 110.584 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -64.44 109.32 1.9 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.689 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 60.3 29.9 19.39 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.539 0.685 . . . . 10.0 109.779 -178.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 41.7 t0 65.37 22.18 11.98 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.269 -1.332 . . . . 10.0 111.154 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.41 -89.18 0.38 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.488 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.6 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 34.5 tt0 -88.79 125.9 61.32 Favored Pre-proline 0 C--O 1.235 0.302 0 CA-C-O 120.705 0.288 . . . . 10.0 111.426 -178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.423 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.4 Cg_endo -79.07 121.81 5.05 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.804 2.336 . . . . 10.0 111.582 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -140.49 164.31 30.47 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -90.75 127.68 36.41 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.514 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t0 -138.27 134.0 33.81 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.81 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.9 tt -110.21 120.95 62.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.514 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -143.9 169.84 17.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.543 0.687 . . . . 10.0 112.286 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.525 ' CG2' ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -113.21 131.13 56.01 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 114.838 -1.074 . . . . 10.0 110.356 179.467 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m0 -117.5 175.41 5.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.234 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.84 158.04 86.52 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -58.12 -33.02 96.94 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.529 2.152 . . . . 10.0 112.32 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -94.87 1.04 55.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.473 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 24.8 m170 62.28 24.27 14.43 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.284 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -66.99 -38.28 85.75 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.856 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -139.48 174.27 10.69 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.209 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.22 172.76 11.46 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.648 -178.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.433 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -139.9 -173.51 13.28 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.518 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 6.8 mtpp -93.64 136.31 34.05 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.243 -0.563 . . . . 10.0 111.863 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.45 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -134.96 -123.01 2.29 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 110.65 -0.98 . . . . 10.0 110.65 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.3 tt -150.43 143.05 17.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.39 0.595 . . . . 10.0 110.798 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.96 134.58 46.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.731 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 46.7 mt -112.69 120.24 40.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.96 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.06 174.97 11.06 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.935 -0.306 . . . . 10.0 110.414 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -58.37 -42.6 87.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.54 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.477 ' O ' HG23 ' B' ' 64' ' ' VAL . 12.1 pt-20 -55.91 -43.83 77.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.387 0.613 . . . . 10.0 110.678 178.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.543 ' HA ' HD13 ' A' ' 16' ' ' LEU . 31.3 mt-10 -70.94 -58.58 3.44 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.365 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 0.8 OUTLIER -52.74 -40.62 63.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.594 -178.425 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.27 -56.33 24.25 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.905 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.518 ' HB ' HD22 ' A' ' 16' ' ' LEU . 13.5 t -68.24 -44.79 83.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.844 0.354 . . . . 10.0 111.366 -179.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.1 tp -57.12 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.531 -178.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.651 ' HB3' HD11 ' A' ' 73' ' ' LEU . 23.4 mt -60.1 -52.74 64.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.6 0.238 . . . . 10.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttm -49.05 -51.71 29.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.642 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.796 ' HB3' HD12 ' A' ' 14' ' ' ILE . 55.2 mm-40 -69.56 -51.31 36.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.124 -0.489 . . . . 10.0 112.092 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.628 ' HB3' HD22 ' A' ' 66' ' ' LEU . 62.4 mt -57.05 -46.16 82.66 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.701 0.26 . . . . 10.0 111.701 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.35 93.28 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.282 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' ASN . . . . . 0.423 ' HA ' ' HG3' ' B' ' 74' ' ' GLU . 2.0 t-20 -72.06 -30.83 65.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.58 -0.31 . . . . 10.0 111.688 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.677 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 13.9 mmtt -69.36 -25.48 64.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.541 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.579 HD11 ' HB3' ' A' ' 66' ' ' LEU . 19.1 mt -88.62 -2.76 58.76 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.384 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.423 ' HG3' ' HA ' ' B' ' 71' ' ' ASN . 36.6 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.955 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C3'-C2'-C1' 101.902 -0.57 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . 0.418 ' H71' ' O ' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 C3'-C2'-C1' 101.348 -0.965 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -0.968 0 O4'-C1'-C2' 104.184 -1.742 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.851 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 O4'-C4'-C3' 103.408 -2.192 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.482 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 O4'-C4'-C3' 103.546 -2.054 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.906 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.904 0 C5'-C4'-O4' 113.184 2.365 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 C3'-C2'-C1' 101.166 -1.096 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.843 0 C3'-C2'-C1' 101.167 -1.095 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . 0.498 ' H73' ' HB ' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C3'-C2'-C1' 101.93 -0.55 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.929 0 O4'-C1'-C2' 104.348 -1.592 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.83 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.835 0 O4'-C4'-C3' 103.528 -2.072 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.481 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 O4'-C4'-C3' 103.857 -1.743 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.88 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.822 0 C5'-C4'-O4' 113.092 2.308 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.6 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.425 -0.931 0 C3'-C2'-C1' 100.82 -1.343 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.789 0.328 . . . . 10.0 110.426 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.47 163.53 13.37 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -72.28 -50.86 23.9 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.611 -0.514 . . . . 10.0 109.611 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -134.77 94.57 3.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.887 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.691 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.3 tp -68.46 140.53 55.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.463 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.48 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -74.53 131.47 41.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.616 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.553 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 11.4 p90 -158.03 171.83 19.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.393 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.418 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.27 135.19 12.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.346 -0.612 . . . . 10.0 109.346 178.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.425 ' HA ' HG12 ' A' ' 30' ' ' VAL . 65.1 mt -83.38 117.47 29.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 mm -84.95 -49.25 15.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.293 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -165.77 134.17 3.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.263 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -79.47 137.83 37.36 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.276 -0.638 . . . . 10.0 109.276 178.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.572 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 87.9 mt -105.75 -72.1 0.72 Allowed 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.793 -0.363 . . . . 10.0 111.467 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.606 HD12 ' HB3' ' B' ' 68' ' ' GLU . 27.2 mm -131.75 140.86 47.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.094 0.474 . . . . 10.0 111.924 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.76 120.8 58.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 108.11 -1.07 . . . . 10.0 108.11 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.608 HD22 ' HB ' ' B' ' 64' ' ' VAL . 25.6 mt -91.02 -80.77 0.33 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.159 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 179.36 -170.38 0.13 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -106.67 140.08 40.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.817 0.341 . . . . 10.0 110.239 179.004 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -77.48 -174.63 3.43 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.01 -24.47 67.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.536 0.684 . . . . 10.0 110.837 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.415 ' HB3' H2'' ' C' ' 1' ' ' ' DT' . 20.7 mttt -90.21 3.02 54.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.155 -0.93 . . . . 10.0 110.692 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.06 6.01 87.01 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.207 -0.757 . . . . 10.0 111.207 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.433 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.6 m0 -62.1 100.33 0.16 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.839 0.352 . . . . 10.0 111.346 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 43' ' ' THR . 13.3 tpp85 -81.12 99.42 8.5 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' A' ' 43' ' ' THR . 89.9 mttt -83.5 112.23 19.78 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.864 0.364 . . . . 10.0 110.52 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -131.55 149.31 52.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.842 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.679 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.3 tp -118.3 108.16 14.76 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.099 -1.075 . . . . 10.0 108.099 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -133.38 160.7 36.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 10.0 111.152 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 29' ' ' ARG . 32.6 ttm180 -96.79 114.97 26.65 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' A' ' 9' ' ' ILE . 17.2 m -127.92 160.47 37.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.801 0.334 . . . . 10.0 110.569 -179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.6 p -96.58 122.53 39.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.926 0.393 . . . . 10.0 110.453 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -64.2 109.97 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.014 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.2 m-80 59.12 31.0 20.91 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.781 0.676 . . . . 10.0 110.158 -178.465 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t70 61.61 30.06 18.47 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.763 -1.108 . . . . 10.0 110.959 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.75 -77.83 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.058 -0.402 . . . . 10.0 111.705 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -97.12 120.47 61.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 120.631 0.253 . . . . 10.0 111.589 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.502 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 69.0 Cg_endo -78.62 120.85 4.9 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.484 2.123 . . . . 10.0 111.325 178.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -141.25 168.5 19.62 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.424 ' HD1' HD11 ' A' ' 13' ' ' LEU . 2.8 m-85 -93.26 130.47 38.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.44 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -141.54 130.02 22.56 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.679 ' HB ' HD13 ' A' ' 27' ' ' LEU . 6.4 tt -106.32 121.31 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.345 0.593 . . . . 10.0 109.953 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.507 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.9 mtt85 -144.65 177.6 8.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.19 -177.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.581 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -120.77 142.22 49.77 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.497 179.197 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -117.01 176.63 5.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.29 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.431 ' HG ' ' H ' ' A' ' 50' ' ' LYS . 2.3 p -79.39 158.38 74.04 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -58.75 -30.86 93.75 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.53 2.153 . . . . 10.0 112.162 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -94.27 -5.35 46.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.834 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 60.83 34.59 19.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.6 -178.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -88.26 -32.51 18.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.472 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.431 ' H ' ' HG ' ' A' ' 45' ' ' SER . 39.0 mmtm -141.84 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.119 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -145.42 172.73 12.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.278 -177.701 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.618 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -133.63 -154.82 7.49 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.092 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.4 ' HA ' ' NH2' ' A' ' 42' ' ' ARG . 36.5 mttp -101.58 157.3 16.92 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 122.169 -0.607 . . . . 10.0 112.066 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.81 -122.36 0.99 Allowed Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.775 -0.93 . . . . 10.0 110.775 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -149.38 141.42 17.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 117.759 0.78 . . . . 10.0 111.367 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.51 144.67 31.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -129.79 130.66 45.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.113 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -84.97 175.21 9.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.774 -0.194 . . . . 10.0 110.905 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -53.69 -58.68 6.32 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.49 0.552 . . . . 10.0 112.49 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -57.69 -49.01 77.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.757 0.313 . . . . 10.0 111.829 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -58.99 -49.0 79.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.204 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.666 ' CE2' HD11 ' A' ' 66' ' ' LEU . 25.2 t80 -62.62 -44.07 97.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.486 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.53 -54.56 36.21 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.101 -0.499 . . . . 10.0 112.917 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.448 ' HB ' HD22 ' B' ' 16' ' ' LEU . 53.4 t -60.2 -42.14 89.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.295 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.486 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -57.59 -53.06 62.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.462 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.681 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.2 mt -62.18 -46.14 90.26 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 -179.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -51.27 -51.35 54.99 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 123.635 0.584 . . . . 10.0 111.522 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.605 ' CB ' HD12 ' B' ' 14' ' ' ILE . 49.9 mm-40 -70.24 -46.69 63.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.339 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 69.0 mt -58.53 -44.15 89.47 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 111.682 0.253 . . . . 10.0 111.682 -179.177 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.57 -38.87 97.09 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.824 -0.703 . . . . 10.0 111.596 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -71.37 -29.05 64.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.813 0.34 . . . . 10.0 110.755 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 54.5 mmtt -66.55 -25.11 66.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.362 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' B' ' 66' ' ' LEU . 24.2 mt -85.68 -11.93 52.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.448 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.706 -0.664 . . . . 10.0 110.635 179.947 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.859 0.361 . . . . 10.0 110.446 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.01 160.57 16.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.416 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 14.8 t70 -72.22 -48.37 43.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.416 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 32.8 mmtm -135.05 94.46 3.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.66 -0.7 . . . . 10.0 109.546 179.006 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.741 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 26.9 tp -68.84 140.32 55.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.407 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -74.05 129.72 38.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.597 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.661 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.9 p90 -158.01 170.04 23.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.064 -0.517 . . . . 10.0 110.263 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.441 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 6.2 tp10 -152.63 133.05 13.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.506 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.578 ' HA ' HG12 ' B' ' 30' ' ' VAL . 63.7 mt -82.07 117.81 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.093 0.473 . . . . 10.0 110.124 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 39.5 mm -85.24 -50.82 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.377 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 -162.94 133.38 4.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.43 142.64 37.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.1 mt -112.43 -67.95 0.96 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.64 -0.424 . . . . 10.0 111.677 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.605 HD12 ' CB ' ' A' ' 68' ' ' GLU . 21.2 mm -133.03 141.38 44.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.826 0.346 . . . . 10.0 111.787 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -128.31 116.74 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 177.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' LEU . . . . . 0.448 HD22 ' HB ' ' A' ' 64' ' ' VAL . 34.6 mt -86.14 -81.07 0.22 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.616 -177.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 178.99 -168.48 0.09 Allowed 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.473 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 0.8 OUTLIER -108.39 141.37 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.154 -0.313 . . . . 10.0 110.154 178.841 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -78.82 -172.76 3.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.25 66.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 10.0 110.879 -179.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' LYS . . . . . 0.434 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 22.6 mttt -93.24 2.74 56.5 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.376 -0.829 . . . . 10.0 110.198 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.43 5.5 84.86 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.664 -0.779 . . . . 10.0 111.436 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.473 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -61.33 101.61 0.18 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.867 0.365 . . . . 10.0 111.641 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' B' ' 43' ' ' THR . 14.1 tpp85 -81.63 99.72 9.03 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.408 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.603 ' HG2' HG22 ' B' ' 43' ' ' THR . 90.5 mttt -83.46 113.6 20.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.974 0.416 . . . . 10.0 110.907 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -132.98 148.95 52.27 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.639 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.718 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.8 tp -119.3 107.62 13.62 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 178.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -133.18 161.33 34.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.968 0.413 . . . . 10.0 111.211 -177.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -97.7 114.68 26.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.578 HG12 ' HA ' ' B' ' 9' ' ' ILE . 23.0 m -127.28 159.92 36.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.518 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.2 p -95.01 122.85 38.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 10.0 110.775 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -64.27 110.45 2.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.783 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 65.1 m-80 59.43 29.26 18.8 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.23 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 64.11 24.81 13.58 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.834 -1.075 . . . . 10.0 110.903 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.9 -82.98 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.764 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.454 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 34.4 tt0 -92.42 120.41 67.53 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 10.0 111.63 -178.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.2 Cg_endo -76.84 124.05 7.22 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.617 2.212 . . . . 10.0 111.124 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.405 ' HD2' ' CG2' ' B' ' 56' ' ' THR . 22.0 ttmm -144.28 165.94 26.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -92.0 129.52 37.94 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -140.26 130.01 24.45 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.718 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.1 tt -105.53 121.59 57.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 10.0 109.951 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.48 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 2.9 mtt85 -145.04 176.85 9.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.398 -177.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.603 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -120.56 142.2 49.57 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.645 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -116.92 177.34 4.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.028 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -80.97 159.48 68.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.49 -28.79 88.37 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.385 2.056 . . . . 10.0 112.073 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.35 -5.75 42.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.641 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 62.53 28.35 16.68 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.984 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.55 -36.42 29.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.713 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -138.51 172.56 12.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.452 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.457 ' O ' " H1'" ' C' ' 13' ' ' ' DT' . 0.0 OUTLIER -146.78 172.46 13.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.418 -177.761 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.533 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -132.82 -154.67 7.61 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.676 -0.773 . . . . 10.0 112.161 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.51 156.09 17.48 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 122.2 -0.588 . . . . 10.0 111.953 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.1 -121.17 1.11 Allowed Glycine 0 N--CA 1.452 -0.297 0 N-CA-C 110.761 -0.936 . . . . 10.0 110.761 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.2 tt -151.43 141.38 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 117.74 0.77 . . . . 10.0 111.166 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.405 ' CG2' ' HD2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -103.96 145.67 29.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.591 -179.575 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 32.6 mt -128.95 128.83 44.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.272 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -83.57 173.36 11.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.696 -0.229 . . . . 10.0 110.867 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -51.86 -56.6 13.04 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.567 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.5 pt-20 -60.53 -47.09 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.808 0.299 . . . . 10.0 111.808 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.32 -47.44 85.93 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.38 . . . . 10.0 110.974 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -66.14 -40.12 90.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.807 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.07 -53.72 43.25 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.093 -0.503 . . . . 10.0 112.857 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.608 ' HB ' HD22 ' A' ' 16' ' ' LEU . 14.1 t -62.31 -41.7 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 120.979 0.419 . . . . 10.0 110.119 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.2 tp -58.25 -52.44 65.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.453 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.463 ' HB3' HD11 ' A' ' 73' ' ' LEU . 49.6 mt -60.36 -48.71 80.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.331 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -50.34 -53.79 26.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 10.0 111.918 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.606 ' HB3' HD12 ' A' ' 14' ' ' ILE . 65.5 mm-40 -69.79 -47.32 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.015 -0.538 . . . . 10.0 111.933 -178.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.681 ' HB3' HD22 ' A' ' 66' ' ' LEU . 59.9 mt -59.91 -44.29 94.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.904 0.335 . . . . 10.0 111.904 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.16 -36.48 93.02 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.466 -0.873 . . . . 10.0 111.289 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.46 -28.39 61.02 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.699 0.285 . . . . 10.0 111.153 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.8 mmtt -65.45 -24.46 67.18 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 111.968 0.359 . . . . 10.0 111.968 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.647 HD11 ' HB3' ' A' ' 66' ' ' LEU . 23.2 mt -88.85 -4.28 58.52 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.722 -0.391 . . . . 10.0 111.53 -179.496 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.644 -0.694 . . . . 10.0 110.116 179.35 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . 0.415 H2'' ' HB3' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 101.643 -0.755 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C3'-C2'-C1' 101.459 -0.886 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . 0.457 " H1'" ' O ' ' A' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 O4'-C1'-C2' 104.331 -1.608 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.698 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 O4'-C4'-C3' 103.613 -1.987 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.626 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C4'-C3' 103.587 -2.013 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.789 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.858 0 C5'-C4'-O4' 113.075 2.297 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.989 0 C3'-C2'-C1' 101.391 -0.935 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . 0.609 ' OP2' " H4'" ' C' ' 11' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 101.3 -1.0 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.968 0 C3'-C2'-C1' 101.805 -0.639 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.457 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.409 -0.849 0 O4'-C1'-C2' 104.348 -1.593 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.741 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 O4'-C4'-C3' 103.542 -2.058 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.562 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.869 0 O4'-C4'-C3' 103.762 -1.838 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.805 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.933 0 C5'-C4'-O4' 113.133 2.333 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.454 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.425 -0.954 0 C3'-C2'-C1' 101.133 -1.119 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mmt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.976 0.417 . . . . 10.0 110.265 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.33 172.17 6.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.273 -0.421 . . . . 10.0 109.917 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.581 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 32.2 t70 -76.86 -57.0 4.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.011 0.434 . . . . 10.0 110.001 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.581 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 38.5 mmtm -135.42 95.38 3.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.873 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.754 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.9 tp -64.52 141.76 58.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.801 0.334 . . . . 10.0 110.532 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -77.21 131.7 38.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.221 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.531 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 12.2 p90 -155.43 174.25 15.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.501 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.552 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.52 127.07 7.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.908 179.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.427 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.6 mt -81.54 111.81 18.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.141 0.496 . . . . 10.0 109.727 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.447 HG13 ' HB3' ' A' ' 37' ' ' PRO . 29.8 mm -80.28 -50.89 16.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.506 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -159.86 130.31 5.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.418 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -74.44 142.61 44.92 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 73.4 mt -110.64 -75.18 0.63 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.294 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.713 HD12 ' HB3' ' B' ' 68' ' ' GLU . 27.8 mm -132.45 140.96 46.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.227 0.537 . . . . 10.0 112.146 -177.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.86 123.58 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 107.962 -1.125 . . . . 10.0 107.962 177.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.598 HD22 ' HB ' ' B' ' 64' ' ' VAL . 31.0 mt -94.65 -81.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.531 -0.468 . . . . 10.0 112.208 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 m -176.34 -168.38 0.25 Allowed 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.427 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -106.6 147.56 29.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.754 179.235 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -83.61 -172.78 4.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.19 -26.22 68.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.819 0.819 . . . . 10.0 109.911 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.436 ' HG2' ' C2 ' ' C' ' 1' ' ' ' DT' . 20.2 mttt -88.67 -0.6 57.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.739 -1.118 . . . . 10.0 111.025 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.76 5.1 81.86 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.619 -0.8 . . . . 10.0 111.5 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.427 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -62.41 106.76 0.8 Allowed 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.866 0.365 . . . . 10.0 111.187 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.5 tpp85 -82.94 100.06 10.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.551 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.683 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.3 mttt -81.39 116.57 21.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.881 0.372 . . . . 10.0 110.56 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -132.97 152.24 51.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.084 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.656 HD13 ' HB ' ' A' ' 41' ' ' ILE . 46.3 tp -121.28 108.16 13.39 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 107.79 -1.189 . . . . 10.0 107.79 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -132.17 159.57 38.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 10.0 110.794 -178.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -96.9 113.65 25.2 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.284 -1.006 . . . . 10.0 108.284 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.427 HG12 ' HA ' ' A' ' 9' ' ' ILE . 11.4 m -127.37 158.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.776 0.322 . . . . 10.0 110.894 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.552 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -95.83 125.03 40.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.633 179.103 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.9 m0 -64.23 107.61 1.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.674 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.2 m-80 61.21 31.12 19.54 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.513 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.9 t0 66.33 17.08 10.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.056 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.82 -85.08 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.087 -0.383 . . . . 10.0 111.818 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -96.18 122.61 57.54 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 111.922 0.342 . . . . 10.0 111.922 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.504 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.7 Cg_endo -77.27 125.3 7.7 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.067 2.511 . . . . 10.0 111.676 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -143.35 167.98 20.88 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -93.96 126.38 39.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.209 -0.293 . . . . 10.0 110.209 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.45 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -138.27 133.2 32.81 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.656 ' HB ' HD13 ' A' ' 27' ' ' LEU . 14.5 tt -108.2 121.25 60.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.353 0.597 . . . . 10.0 109.956 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.557 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtt85 -144.44 -179.84 6.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.234 -177.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.683 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -123.73 145.38 49.05 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.688 179.267 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.5 m95 -117.48 168.44 10.38 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.96 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.1 m -66.79 157.74 82.68 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 178.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -51.7 -31.7 42.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.093 2.529 . . . . 10.0 113.28 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -107.5 11.92 28.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.226 0.536 . . . . 10.0 110.459 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 54.3 m80 59.03 25.36 13.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.949 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -73.84 -39.67 63.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.734 0.302 . . . . 10.0 111.084 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -133.51 175.42 9.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.316 0.579 . . . . 10.0 111.087 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.423 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -140.43 172.78 12.25 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.497 -178.31 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.692 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -138.44 -161.55 8.85 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.583 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -97.77 146.0 25.82 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 122.279 -0.542 . . . . 10.0 112.331 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.443 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -143.15 -126.99 2.08 Favored Glycine 0 CA--C 1.519 0.299 0 N-CA-C 111.097 -0.801 . . . . 10.0 111.097 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 tt -146.77 142.93 20.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 117.888 0.844 . . . . 10.0 111.519 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.0 144.66 30.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.785 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.1 mt -123.77 131.38 53.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.573 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -77.92 171.67 14.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.943 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -64.54 -46.54 82.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.506 0.193 . . . . 10.0 111.248 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.17 -43.8 95.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.231 0.539 . . . . 10.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.413 ' HB3' HD13 ' B' ' 16' ' ' LEU . 74.0 mt-10 -65.28 -52.66 52.8 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.113 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 66' ' ' LEU . 21.1 t80 -56.25 -43.72 78.98 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.343 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.68 -54.11 39.75 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.14 -0.552 . . . . 10.0 112.729 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 89.4 t -62.22 -42.47 95.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.768 0.318 . . . . 10.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.461 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 14.9 tp -58.53 -52.58 65.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.402 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.704 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.4 mt -61.87 -46.05 91.13 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.483 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -51.54 -52.82 43.93 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 123.456 0.473 . . . . 10.0 111.194 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.538 ' CB ' HD12 ' B' ' 14' ' ' ILE . 70.6 mm-40 -68.68 -46.75 68.23 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.711 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 79.9 mt -60.14 -43.67 95.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.683 0.277 . . . . 10.0 111.411 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.61 -33.99 88.73 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.72 -0.753 . . . . 10.0 111.346 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -73.98 -28.37 61.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.882 0.373 . . . . 10.0 110.786 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.64 -27.5 66.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.967 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' B' ' 66' ' ' LEU . 42.0 mt -90.0 -5.25 56.85 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.735 0.272 . . . . 10.0 111.735 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.656 -0.687 . . . . 10.0 110.665 -179.705 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.931 0.396 . . . . 10.0 109.976 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.53 168.18 9.43 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.448 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 36.1 t70 -76.49 -53.32 8.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.055 0.455 . . . . 10.0 110.078 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.448 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 38.2 mmtm -136.29 94.54 3.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.685 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.682 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 25.6 tp -65.4 139.26 58.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.856 0.36 . . . . 10.0 110.602 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.474 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.2 tppt? -75.58 130.69 39.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.57 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.626 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.6 p90 -153.94 174.3 14.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.196 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.524 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.8 tp10 -155.11 122.37 5.56 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.806 179.097 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.498 ' HA ' HG12 ' B' ' 30' ' ' VAL . 44.7 mt -77.65 109.83 12.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' B' ' 37' ' ' PRO . 28.6 mm -79.01 -51.83 16.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.664 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -158.87 127.97 5.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.265 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -72.26 145.06 48.16 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 53.1 mt -113.29 -72.12 0.72 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.488 -179.176 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.538 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.9 mm -133.17 140.63 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 10.0 112.052 -177.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' B' ' 26' ' ' GLU . 4.6 p -123.48 123.77 68.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 107.969 -1.123 . . . . 10.0 107.969 177.223 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 16' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 61' ' ' GLU . 30.5 mt -94.92 -81.19 0.4 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.473 -0.491 . . . . 10.0 112.012 -177.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.46 -168.42 0.15 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 -179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -106.87 147.57 29.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 10.0 110.271 179.311 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -83.69 -168.0 1.94 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.141 -0.482 . . . . 10.0 109.75 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.1 -23.45 64.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.282 0.563 . . . . 10.0 110.356 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -91.78 1.03 57.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.419 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.82 4.66 82.19 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.51 -0.852 . . . . 10.0 111.636 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -61.94 106.16 0.67 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.742 0.306 . . . . 10.0 110.973 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' B' ' 43' ' ' THR . 7.9 tpp85 -83.02 100.43 10.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.809 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.713 ' HG2' HG22 ' B' ' 43' ' ' THR . 93.3 mttt -81.03 116.97 21.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 10.0 110.891 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.443 ' HG2' HG23 ' B' ' 15' ' ' VAL . 66.9 mt-10 -132.57 150.39 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.937 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.632 HD13 ' HB ' ' B' ' 41' ' ' ILE . 41.2 tp -120.14 107.94 13.63 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.95 -1.13 . . . . 10.0 107.95 178.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -133.27 158.0 44.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.939 0.4 . . . . 10.0 111.159 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -94.93 114.0 25.79 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.414 -0.958 . . . . 10.0 108.414 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.498 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.2 m -128.16 156.15 40.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.362 . . . . 10.0 110.883 -178.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.524 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.7 OUTLIER -95.11 125.58 39.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.033 0.444 . . . . 10.0 110.626 179.175 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 10.5 m0 -64.24 110.11 2.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.956 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.474 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.7 m-80 60.6 28.71 18.41 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.667 0.604 . . . . 10.0 110.356 -178.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 40.4 t0 62.66 32.22 16.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.037 -0.983 . . . . 10.0 110.214 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.62 -82.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.025 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -98.16 122.38 54.35 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-O 120.646 0.26 . . . . 10.0 111.515 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.505 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 70.3 Cg_endo -77.12 121.78 5.92 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.809 2.339 . . . . 10.0 111.654 178.757 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.407 ' HD2' ' CG2' ' B' ' 56' ' ' THR . 19.7 ttmm -139.75 167.5 21.96 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -95.04 126.83 40.65 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.467 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -138.15 132.82 32.52 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.611 -0.515 . . . . 10.0 109.611 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.632 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.9 tt -106.44 121.76 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.183 0.516 . . . . 10.0 109.73 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.546 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.0 mtt85 -144.87 178.48 7.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.268 0.556 . . . . 10.0 111.599 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.713 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -121.86 145.0 48.51 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.573 -0.739 . . . . 10.0 109.743 179.453 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -117.73 167.09 11.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.673 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 16.6 m -66.35 157.98 79.69 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.504 -0.554 . . . . 10.0 109.504 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -51.48 -33.24 46.48 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.975 2.45 . . . . 10.0 112.908 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -105.1 11.29 33.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.102 0.477 . . . . 10.0 110.91 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.2 m80 57.76 27.66 14.75 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.38 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.23 -39.85 59.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.825 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -134.68 175.17 9.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 10.0 111.132 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 51' ' ' MET . . . . . 0.423 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -141.19 172.63 12.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.257 -0.883 . . . . 10.0 110.363 -178.111 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.667 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.63 -159.97 8.25 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.566 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -97.41 146.47 25.16 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.184 -0.598 . . . . 10.0 112.241 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.426 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -142.4 -129.02 2.34 Favored Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -147.48 140.9 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 117.666 0.733 . . . . 10.0 111.22 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.407 ' CG2' ' HD2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -100.83 147.92 25.54 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.16 -179.796 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 87.6 mt -126.52 132.94 51.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.383 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -79.92 169.52 17.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.27 -47.95 83.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 10.0 111.145 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.645 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.5 pt-20 -58.57 -44.31 89.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.608 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.463 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 65.6 mt-10 -66.48 -52.73 43.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.023 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.49 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.1 t80 -57.16 -41.56 79.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.858 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.75 -53.46 45.79 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.27 -0.491 . . . . 10.0 112.84 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.645 HG23 ' O ' ' B' ' 60' ' ' GLU . 15.6 t -62.97 -43.51 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.877 0.37 . . . . 10.0 110.503 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.1 tp -58.33 -51.98 67.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.358 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.573 ' HB3' HD11 ' A' ' 73' ' ' LEU . 62.1 mt -60.1 -49.61 76.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.812 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -50.74 -54.62 21.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.661 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.713 ' HB3' HD12 ' A' ' 14' ' ' ILE . 39.6 mm-40 -67.42 -47.57 69.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.053 -0.521 . . . . 10.0 112.027 -178.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.643 ' HB3' HD22 ' A' ' 66' ' ' LEU . 72.5 mt -61.75 -42.12 98.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.5 0.19 . . . . 10.0 111.455 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.73 -37.37 94.71 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -72.02 -28.81 63.62 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.023 0.44 . . . . 10.0 110.911 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.5 mmtt -64.44 -32.27 73.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.065 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.539 HD11 ' CB ' ' A' ' 66' ' ' LEU . 24.9 mt -90.66 6.06 45.49 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.794 -0.622 . . . . 10.0 109.788 179.209 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . 0.436 ' C2 ' ' HG2' ' A' ' 21' ' ' LYS . . . . . . . . 0 C2'--C1' 1.512 -0.659 0 C3'-C2'-C1' 101.63 -0.764 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 101.596 -0.789 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.014 0 O4'-C1'-C2' 104.266 -1.668 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.754 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.793 0 O4'-C4'-C3' 103.47 -2.13 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.566 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.757 0 O4'-C4'-C3' 103.361 -2.239 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.825 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.885 0 C5'-C4'-O4' 113.218 2.386 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.924 0 C3'-C2'-C1' 101.111 -1.135 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.969 0 C3'-C2'-C1' 101.316 -0.989 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.997 0 C3'-C2'-C1' 101.785 -0.653 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 O4'-C1'-C2' 104.344 -1.597 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.682 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.812 0 O4'-C4'-C3' 103.531 -2.069 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.567 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.838 0 O4'-C4'-C3' 103.629 -1.971 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.838 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.932 0 C5'-C4'-O4' 113.056 2.285 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 C3'-C2'-C1' 101.044 -1.183 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 mmt . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 120.889 0.376 . . . . 10.0 110.175 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 168.29 10.45 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.115 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.96 -58.22 3.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -135.95 105.19 5.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.748 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 38.0 tp -78.26 143.28 37.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 10.0 110.423 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -78.63 139.41 38.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.968 0.413 . . . . 10.0 111.268 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.478 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 12.4 p90 -162.84 175.92 10.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.608 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.44 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.9 tp10 -160.13 131.14 5.73 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.019 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.8 mt -80.38 112.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.785 0.326 . . . . 10.0 110.208 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.2 mm -85.48 -39.47 13.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.657 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -165.8 127.25 1.91 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.571 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.55 142.63 37.2 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 178.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.465 ' O ' HD13 ' A' ' 14' ' ' ILE . 72.2 mt -111.43 -74.47 0.64 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.559 -0.457 . . . . 10.0 111.627 -178.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.668 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.1 mm -129.41 144.57 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.143 0.497 . . . . 10.0 111.855 -177.61 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.401 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.6 p -128.56 126.52 65.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.653 HD13 ' HA ' ' B' ' 61' ' ' GLU . 36.0 mt -95.33 -80.57 0.41 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.704 -0.398 . . . . 10.0 111.249 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 m 175.82 -173.93 0.09 Allowed 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.378 0.671 . . . . 10.0 109.487 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.492 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -99.58 151.86 20.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.293 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -94.18 -173.33 3.06 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.07 -26.4 67.61 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.639 0.733 . . . . 10.0 110.811 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -89.17 3.09 53.09 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.022 -0.99 . . . . 10.0 110.719 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.36 -1.54 88.55 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.817 -0.706 . . . . 10.0 111.466 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.499 ' HB3' ' CG2' ' A' ' 43' ' ' THR . 40.2 m0 -56.13 107.05 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.987 0.366 . . . . 10.0 111.987 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 tpp85 -80.18 108.74 14.03 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.537 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 78.9 mttt -85.46 112.0 20.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.292 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.401 ' HG2' HG23 ' A' ' 15' ' ' VAL . 50.3 mt-10 -138.59 155.44 48.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.667 0.746 . . . . 10.0 112.122 -179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.801 HD13 ' HB ' ' A' ' 41' ' ' ILE . 36.4 tp -127.7 110.4 12.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.668 -1.151 . . . . 10.0 108.393 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.04 162.77 31.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.05 0.453 . . . . 10.0 111.795 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -94.84 114.72 26.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 178.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.4 m -129.54 156.74 42.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.974 0.416 . . . . 10.0 111.246 -179.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.5 p -96.83 122.3 39.65 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.04 0.447 . . . . 10.0 110.627 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -63.92 111.23 2.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.962 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 58.93 27.97 16.95 Favored 'General case' 0 N--CA 1.463 0.179 0 O-C-N 123.806 0.691 . . . . 10.0 110.44 -178.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.1 t70 64.76 25.64 12.97 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.232 -0.895 . . . . 10.0 110.891 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.69 -80.22 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.335 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -98.32 123.74 49.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.541 0.21 . . . . 10.0 111.41 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 74.4 Cg_endo -81.05 123.86 4.72 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.997 2.464 . . . . 10.0 111.685 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -143.85 168.69 19.35 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.87 136.77 32.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.58 129.33 15.18 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.801 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -108.73 122.62 63.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.251 0.548 . . . . 10.0 109.579 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.596 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.1 mtt85 -146.45 176.16 10.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.42 0.629 . . . . 10.0 111.977 -177.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.537 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -117.38 131.28 56.8 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 114.799 -1.091 . . . . 10.0 109.718 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.0 m0 -117.26 177.52 4.7 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.757 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -72.96 155.39 90.52 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.57 -24.07 70.19 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.195 1.93 . . . . 10.0 112.068 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -98.05 -0.86 43.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.861 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.2 m170 61.34 20.88 11.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.405 -0.816 . . . . 10.0 110.703 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.42 ' H ' ' HG2' ' A' ' 49' ' ' GLU . 12.2 pt-20 -71.7 -39.34 70.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.033 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -135.35 174.3 10.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.224 0.535 . . . . 10.0 111.194 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.403 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -140.74 171.79 13.61 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.183 -0.917 . . . . 10.0 110.407 -177.959 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.665 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -137.91 -161.74 8.99 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.637 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.5 mttp -99.94 145.87 27.33 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -145.41 -121.01 1.38 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 111.08 -0.808 . . . . 10.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 12.7 tt -148.84 142.55 18.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.521 0.66 . . . . 10.0 111.14 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -101.73 136.84 40.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.833 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.4 mt -117.09 120.48 38.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.925 0.393 . . . . 10.0 110.27 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.502 ' HB3' ' HG2' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -80.6 172.49 13.69 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.502 179.586 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -58.22 -43.05 87.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 10.0 111.503 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.572 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.2 pt-20 -54.44 -47.38 72.95 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.39 0.614 . . . . 10.0 110.509 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.572 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 26.7 mt-10 -68.23 -58.64 4.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.052 -0.977 . . . . 10.0 111.326 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.629 ' CE2' HD11 ' A' ' 66' ' ' LEU . 10.1 t80 -49.82 -44.83 49.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.401 -0.818 . . . . 10.0 111.867 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.87 -58.5 13.42 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.229 -0.51 . . . . 10.0 113.181 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -65.17 -40.93 90.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.883 0.373 . . . . 10.0 111.296 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.477 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.1 tp -58.24 -53.84 53.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.958 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.629 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.1 mt -61.92 -43.84 98.01 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.106 -0.237 . . . . 10.0 111.356 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.1 tttm -50.76 -53.31 32.75 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 123.616 0.572 . . . . 10.0 111.07 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.514 ' CB ' HD12 ' B' ' 14' ' ' ILE . 25.2 mm-40 -72.07 -44.56 63.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.706 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 44.0 mt -59.43 -44.0 92.98 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.424 0.157 . . . . 10.0 111.424 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.4 94.67 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.459 -0.876 . . . . 10.0 110.987 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.75 -28.15 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.702 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 72.3 mmtt -68.54 -30.7 69.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.285 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.499 HD11 ' HB3' ' B' ' 66' ' ' LEU . 19.4 mt -88.49 2.56 52.62 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.243 -0.183 . . . . 10.0 111.419 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.471 -0.776 . . . . 10.0 110.309 179.857 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.3 mmt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.915 0.388 . . . . 10.0 110.18 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.24 163.47 13.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.322 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.426 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 4.6 t70 -66.32 -60.37 2.83 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.426 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 35.1 mmtm -132.5 104.64 6.79 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.751 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 37.3 tp -77.56 142.71 38.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.814 0.34 . . . . 10.0 110.692 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -79.36 136.27 36.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.078 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.564 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.3 p90 -160.11 174.77 13.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.681 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.449 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 13.5 tp10 -158.64 126.57 5.14 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.059 -0.348 . . . . 10.0 110.059 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.403 ' HA ' HG12 ' B' ' 30' ' ' VAL . 71.9 mt -76.0 114.55 16.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.064 0.459 . . . . 10.0 110.156 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 32.0 mm -86.99 -41.26 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.428 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -164.48 127.53 2.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.771 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -76.52 142.89 40.72 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.4 mt -111.75 -72.55 0.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.521 -0.472 . . . . 10.0 111.861 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.514 HD12 ' CB ' ' A' ' 68' ' ' GLU . 21.5 mm -131.5 144.2 38.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 10.0 111.496 -177.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.415 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -129.16 123.36 58.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 177.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 26.5 mt -92.3 -80.81 0.36 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.905 -0.318 . . . . 10.0 111.445 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 176.59 -172.05 0.09 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.302 0.641 . . . . 10.0 109.386 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.447 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.9 mp0 -101.34 150.87 22.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 19' ' ' ASN . . . . . 0.4 ' CG ' ' H ' ' B' ' 20' ' ' ALA . 18.0 t-20 -90.91 -174.51 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.781 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 20' ' ' ALA . . . . . 0.4 ' H ' ' CG ' ' B' ' 19' ' ' ASN . . . -63.82 -23.83 67.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.453 0.644 . . . . 10.0 110.596 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 21' ' ' LYS . . . . . 0.44 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 24.6 mttt -91.06 1.49 57.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.287 -0.869 . . . . 10.0 110.314 179.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.34 -1.21 87.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.389 -178.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.511 ' HB3' ' CG2' ' B' ' 43' ' ' THR . 40.3 m0 -56.68 107.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.61 109.58 15.27 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' LYS . . . . . 0.445 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 80.8 mttt -86.36 111.58 20.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.611 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.415 ' HG2' HG23 ' B' ' 15' ' ' VAL . 50.2 mt-10 -138.21 157.14 46.88 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.568 0.699 . . . . 10.0 112.138 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.784 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.4 tp -128.88 111.02 12.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.742 -1.117 . . . . 10.0 108.192 178.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -135.57 161.03 36.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.037 0.446 . . . . 10.0 111.435 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 ttm-85 -93.03 114.67 27.29 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.35 -0.981 . . . . 10.0 108.35 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' B' ' 9' ' ' ILE . 18.3 m -128.87 154.99 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.948 0.404 . . . . 10.0 111.076 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.499 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.5 p -95.63 122.72 38.69 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.972 0.415 . . . . 10.0 110.513 179.226 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -63.99 112.39 2.93 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.82 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 57.58 28.13 15.18 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.708 0.63 . . . . 10.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 62.95 30.45 16.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.963 -1.017 . . . . 10.0 110.884 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.77 -79.07 0.58 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.102 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.47 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 35.6 tt0 -99.05 122.06 53.66 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.532 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 65.7 Cg_endo -79.78 122.52 4.94 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.716 2.277 . . . . 10.0 111.709 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -142.99 166.57 24.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -87.41 135.65 33.25 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.5 t0 -147.41 128.57 14.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.784 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.1 tt -107.34 123.25 62.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.517 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.0 mtt85 -146.23 175.05 10.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.494 0.664 . . . . 10.0 112.119 -177.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.511 ' CG2' ' HB3' ' B' ' 23' ' ' TRP . 0.0 OUTLIER -117.45 131.59 56.71 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.728 -1.124 . . . . 10.0 109.887 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 18.0 m0 -117.56 177.99 4.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.56 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.9 m -74.21 155.44 88.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.17 -31.21 89.87 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.073 1.849 . . . . 10.0 112.145 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.14 -3.8 57.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.195 179.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 m170 64.15 24.7 13.52 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.489 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.68 -39.64 61.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.138 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -133.97 174.3 10.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.136 0.493 . . . . 10.0 110.834 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.74 168.82 18.94 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.573 -177.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.587 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -135.04 -163.79 10.23 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.704 -0.76 . . . . 10.0 112.664 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mttp -98.59 144.84 27.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.38 0.511 . . . . 10.0 112.38 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.52 -118.54 1.31 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.8 tt -152.56 142.35 14.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.413 0.607 . . . . 10.0 110.919 179.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.6 m -102.44 135.42 44.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.475 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 68.8 mt -115.75 121.23 41.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.871 0.367 . . . . 10.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.9 m -80.45 174.01 12.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.582 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -59.26 -40.78 87.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.838 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 8.5 pt-20 -55.55 -46.67 77.11 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.606 0.717 . . . . 10.0 110.432 178.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.653 ' HA ' HD13 ' A' ' 16' ' ' LEU . 31.6 mt-10 -68.54 -58.62 4.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.021 -0.991 . . . . 10.0 111.202 -179.226 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -53.83 -39.18 65.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.822 -178.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.32 -59.65 9.59 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.918 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.589 ' HB ' HD22 ' A' ' 16' ' ' LEU . 8.9 t -67.19 -41.04 86.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.627 0.251 . . . . 10.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.58 -53.59 56.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.094 -179.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.499 ' HB3' HD11 ' A' ' 73' ' ' LEU . 45.3 mt -59.01 -49.12 79.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.238 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -50.19 -54.19 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.662 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.668 ' HB3' HD12 ' A' ' 14' ' ' ILE . 21.7 mm-40 -69.38 -46.53 66.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.856 -0.611 . . . . 10.0 112.056 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.615 ' HB3' HD22 ' A' ' 66' ' ' LEU . 46.8 mt -60.57 -43.86 96.82 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.127 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.04 94.11 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.717 -0.953 . . . . 10.0 110.717 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.19 -23.6 61.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.365 -0.418 . . . . 10.0 111.185 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.6 mmtt -70.06 -29.82 66.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.185 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.421 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.5 mt -90.31 4.52 50.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.563 0.22 . . . . 10.0 111.411 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.907 -0.568 . . . . 10.0 109.866 179.071 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 C3'-C2'-C1' 101.449 -0.894 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . 0.453 ' H73' ' HB ' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 101.404 -0.926 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . 0.418 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.956 0 O4'-C1'-C2' 104.182 -1.744 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.748 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C4'-C3' 103.508 -2.092 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.596 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.899 0 O4'-C4'-C3' 103.56 -2.04 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.79 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.822 0 C5'-C4'-O4' 112.945 2.216 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.932 0 C3'-C2'-C1' 101.373 -0.948 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . 0.44 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 101.282 -1.013 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 C3'-C2'-C1' 101.832 -0.62 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.45 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.924 0 O4'-C1'-C2' 104.352 -1.589 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.751 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C4'-C3' 103.502 -2.098 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.517 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.421 -1.158 0 O4'-C4'-C3' 103.706 -1.894 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.829 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.829 0 C5'-C4'-O4' 113.039 2.274 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.47 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 C3'-C2'-C1' 100.941 -1.257 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.6 mmm . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 120.869 0.366 . . . . 10.0 110.228 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.44 154.68 18.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.903 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.475 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 24.3 t70 -60.15 -52.8 63.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.124 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.475 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 24.4 mmtm -137.8 106.41 5.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.859 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.794 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 31.0 tp -82.93 137.3 34.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.081 -0.34 . . . . 10.0 110.081 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -73.23 134.52 44.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.279 -0.418 . . . . 10.0 110.889 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.41 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 8.7 p90 -159.83 168.29 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.257 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.509 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.5 tp10 -147.49 135.22 21.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.145 178.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.465 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.7 mt -83.68 106.69 14.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.433 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.448 HG13 ' HB3' ' A' ' 37' ' ' PRO . 37.2 mm -77.11 -56.51 7.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.937 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -157.83 126.79 5.71 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.062 -179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -73.46 142.61 46.85 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.1 mt -110.69 -75.65 0.62 Allowed 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.368 -0.533 . . . . 10.0 111.539 -178.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.635 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.9 mm -131.03 136.95 56.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.162 0.506 . . . . 10.0 111.741 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.542 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.3 p -117.23 123.18 71.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.246 -1.02 . . . . 10.0 108.246 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -90.45 -80.87 0.32 Allowed 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.764 -0.374 . . . . 10.0 111.308 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.3 m 176.59 -179.13 0.17 Allowed 'General case' 0 C--O 1.235 0.34 0 C-N-CA 122.952 0.501 . . . . 10.0 110.006 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 45.1 mp0 -95.09 164.46 12.86 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.02 -167.69 1.25 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.307 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.48 -25.71 68.14 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 10.0 110.556 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -91.56 0.24 57.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.146 -0.933 . . . . 10.0 110.728 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 -1.56 88.57 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.811 -0.709 . . . . 10.0 111.492 -178.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.508 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.0 m0 -53.05 105.64 0.13 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.569 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.0 tpp85 -80.37 100.16 8.3 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 178.43 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -81.57 112.02 18.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.675 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.542 ' HG2' HG23 ' A' ' 15' ' ' VAL . 54.3 mt-10 -137.98 152.4 48.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.372 0.606 . . . . 10.0 111.58 -179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.78 HD13 ' HB ' ' A' ' 41' ' ' ILE . 34.2 tp -122.99 107.65 12.05 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -134.28 157.76 45.5 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.478 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -97.12 114.32 25.99 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.465 HG12 ' HA ' ' A' ' 9' ' ' ILE . 15.7 m -125.41 162.04 28.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.795 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.509 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -98.78 123.97 43.36 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.95 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -64.28 112.28 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.982 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.42 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.6 m-80 58.72 28.93 17.96 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.681 0.613 . . . . 10.0 110.447 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.7 t70 64.23 27.69 13.91 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.128 -0.942 . . . . 10.0 110.648 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.47 -82.61 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.366 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 31' ' ' SER . 35.7 tt0 -89.19 120.5 69.82 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.556 -178.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.448 ' HB3' HG13 ' A' ' 10' ' ' ILE . 33.8 Cg_endo -82.93 120.64 3.06 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.664 2.243 . . . . 10.0 111.111 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.441 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 16.3 ttpt -148.19 160.73 42.63 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.216 -0.29 . . . . 10.0 110.216 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -81.63 140.0 34.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.628 -0.26 . . . . 10.0 110.692 -178.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.407 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -150.4 133.9 16.49 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.78 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.6 tt -111.86 122.75 66.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.118 0.485 . . . . 10.0 109.92 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.578 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.4 mtt85 -148.14 171.19 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.495 -177.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.569 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.7 p -121.31 134.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -118.76 177.97 4.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.541 0.21 . . . . 10.0 110.872 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.7 m -63.38 151.81 86.59 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.837 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.04 -30.73 83.27 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.528 2.152 . . . . 10.0 111.88 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -91.11 -3.03 57.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.253 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 64.25 24.83 13.44 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.716 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.37 -34.05 61.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.008 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -141.33 174.45 10.53 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.347 0.594 . . . . 10.0 111.722 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.421 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -127.93 172.62 10.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.761 -1.109 . . . . 10.0 110.944 -178.244 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.572 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -140.58 -171.71 12.6 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 121.062 -0.59 . . . . 10.0 112.475 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.8 mttp -99.0 144.33 28.28 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 121.979 -0.718 . . . . 10.0 112.446 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.4 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -143.59 -120.38 1.47 Allowed Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.577 -1.009 . . . . 10.0 110.577 178.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -149.18 142.65 18.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 117.513 0.656 . . . . 10.0 110.818 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.2 m -97.47 139.79 32.88 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.973 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.7 mt -115.8 118.77 33.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.913 0.387 . . . . 10.0 110.594 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -77.5 167.28 21.91 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.8 -39.88 86.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.779 0.323 . . . . 10.0 110.399 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.431 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 6.7 pt-20 -56.63 -46.93 80.68 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.253 178.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 31.5 mt-10 -67.81 -56.37 9.42 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.786 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.702 ' CE2' HD11 ' A' ' 66' ' ' LEU . 7.8 t80 -49.72 -47.95 50.29 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.029 0.831 . . . . 10.0 111.776 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.94 -56.46 25.19 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.39 -0.433 . . . . 10.0 113.382 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.1 t -67.28 -42.33 87.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.82 0.343 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 17.5 tp -58.53 -53.38 58.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.016 -178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.719 HD22 ' HB3' ' B' ' 69' ' ' LEU . 21.2 mt -61.26 -44.41 97.28 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.38 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.7 tttm -52.19 -53.49 42.69 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.046 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.619 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 54.5 mm-40 -70.09 -47.88 59.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.702 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.522 ' HB3' HD22 ' B' ' 66' ' ' LEU . 59.0 mt -58.27 -45.46 87.83 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.633 0.234 . . . . 10.0 111.633 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.3 -35.04 91.46 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.565 -0.826 . . . . 10.0 111.396 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -73.48 -28.72 62.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.491 -0.354 . . . . 10.0 110.859 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.619 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 52.1 mmtt -68.88 -23.4 64.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.986 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.588 HD11 ' HB3' ' B' ' 66' ' ' LEU . 27.3 mt -89.86 -14.35 34.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.868 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.851 -0.595 . . . . 10.0 110.462 -179.642 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 31.9 mmm . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.689 0.28 . . . . 10.0 110.605 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.72 161.04 13.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.44 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 23.2 t70 -66.79 -52.73 40.54 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.44 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 31.6 mmtm -136.98 104.95 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.031 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.779 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 37.4 tp -82.18 133.67 35.27 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.8 tppt? -72.47 133.14 44.69 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.072 0.463 . . . . 10.0 111.282 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.534 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 8.2 p90 -158.35 170.02 23.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.554 179.078 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.483 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.0 tp10 -147.32 133.64 19.55 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.532 ' HA ' HG12 ' B' ' 30' ' ' VAL . 50.9 mt -81.63 105.0 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.98 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 47.3 mm -75.34 -56.93 7.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.071 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -157.58 130.33 7.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.981 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.92 141.31 40.56 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.922 -0.77 . . . . 10.0 108.922 178.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 44.0 mt -110.27 -74.09 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.439 -0.504 . . . . 10.0 111.664 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.506 HD12 ' CB ' ' A' ' 68' ' ' GLU . 19.5 mm -130.29 136.79 57.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.046 0.45 . . . . 10.0 111.714 -177.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.468 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -118.48 120.45 64.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -87.43 -81.15 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.719 -0.392 . . . . 10.0 111.41 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m 176.07 -177.99 0.13 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.017 0.527 . . . . 10.0 109.922 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 36.7 mp0 -96.81 163.92 12.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.15 -166.61 1.13 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.461 -0.2 . . . . 10.0 110.461 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.85 -26.76 68.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.388 0.613 . . . . 10.0 110.89 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -92.04 0.41 57.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.322 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.51 -0.23 89.7 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.632 -0.794 . . . . 10.0 111.666 -178.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' TRP . . . . . 0.513 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -52.72 106.28 0.15 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 112.03 0.382 . . . . 10.0 112.03 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.535 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.3 tpp85 -80.59 100.25 8.52 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -81.59 112.19 18.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.755 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.468 ' HG2' HG23 ' B' ' 15' ' ' VAL . 53.8 mt-10 -138.21 152.94 49.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.387 0.613 . . . . 10.0 111.811 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.753 HD13 ' HB ' ' B' ' 41' ' ' ILE . 36.8 tp -123.08 107.56 11.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.008 -1.108 . . . . 10.0 108.008 178.278 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -134.45 157.28 46.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.565 -0.289 . . . . 10.0 110.714 -178.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -96.67 114.97 26.66 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' B' ' 9' ' ' ILE . 19.4 m -126.69 160.99 34.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.665 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -97.28 124.54 41.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.079 0.466 . . . . 10.0 111.094 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 32' ' ' TRP . . . . . 0.481 ' CH2' ' H72' ' C' ' 17' ' ' ' DT' . 11.5 m0 -64.46 111.75 2.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.008 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.4 m-80 58.4 30.63 19.9 Favored 'General case' 0 CA--C 1.521 -0.139 0 O-C-N 123.802 0.689 . . . . 10.0 110.361 -178.198 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.4 t0 61.0 33.01 19.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.986 -1.006 . . . . 10.0 110.565 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.46 -78.72 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.923 -0.58 . . . . 10.0 111.289 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -92.41 117.55 67.68 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.432 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.4 Cg_endo -81.0 119.98 3.67 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.592 2.195 . . . . 10.0 111.279 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ttpt -148.36 161.62 41.2 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.035 -0.266 . . . . 10.0 110.436 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -81.17 139.53 35.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.876 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.412 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -150.71 132.61 15.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 41' ' ' ILE . . . . . 0.753 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.8 tt -110.25 122.87 65.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-O 121.246 0.546 . . . . 10.0 110.193 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.532 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.1 mtt85 -147.88 170.58 17.35 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.661 -177.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 43' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.5 p -120.53 134.17 55.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m0 -118.03 177.75 4.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.789 -0.187 . . . . 10.0 110.973 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -66.11 151.04 96.15 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.675 -0.239 . . . . 10.0 110.372 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.61 -33.34 96.81 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.569 2.18 . . . . 10.0 111.793 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -87.15 -5.03 59.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.289 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 66.48 21.0 10.87 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.586 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -70.49 -37.87 74.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.956 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -137.79 174.17 10.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.495 0.664 . . . . 10.0 112.293 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.58 172.09 11.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.743 -1.117 . . . . 10.0 110.72 -178.291 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 52' ' ' GLY . . . . . 0.52 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -140.14 -170.18 11.92 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 121.034 -0.603 . . . . 10.0 112.248 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -99.7 142.2 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.987 -0.714 . . . . 10.0 112.53 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.406 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -140.01 -120.64 1.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 110.209 -1.156 . . . . 10.0 110.209 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.3 tt -150.06 143.26 17.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.413 0.607 . . . . 10.0 110.565 179.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m -97.0 140.0 32.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.271 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -116.5 117.71 30.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.845 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -76.22 166.67 23.13 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.22 -39.24 85.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 10.0 110.166 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 60' ' ' GLU . . . . . 0.416 ' HG3' ' N ' ' B' ' 61' ' ' GLU . 7.0 pt-20 -56.88 -44.98 82.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.44 -0.8 . . . . 10.0 110.381 177.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' B' ' 60' ' ' GLU . 33.8 mt-10 -69.63 -56.37 7.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.454 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.552 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.2 t80 -52.25 -44.5 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.82 0.7 . . . . 10.0 111.332 -179.299 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.81 -55.44 30.85 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.907 -0.663 . . . . 10.0 113.128 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.8 t -68.99 -44.18 81.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.895 0.378 . . . . 10.0 111.228 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.25 -52.45 65.27 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.007 -178.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.588 ' HB3' HD11 ' A' ' 73' ' ' LEU . 29.8 mt -59.03 -50.75 72.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.775 0.322 . . . . 10.0 110.742 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -50.08 -55.33 15.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.934 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 68' ' ' GLU . . . . . 0.635 ' HB3' HD12 ' A' ' 14' ' ' ILE . 40.6 mm-40 -67.95 -49.67 60.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.983 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.719 ' HB3' HD22 ' A' ' 66' ' ' LEU . 64.7 mt -58.86 -45.4 90.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.613 0.227 . . . . 10.0 111.613 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.64 -36.72 93.65 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.616 -0.802 . . . . 10.0 111.15 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -73.59 -28.02 61.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.938 0.399 . . . . 10.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.4 mmtt -66.81 -25.93 66.69 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.87 0.367 . . . . 10.0 110.689 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.437 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.5 mt -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.313 179.653 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.77 -0.633 . . . . 10.0 110.205 179.739 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 O5'-C5'-C4' 109.235 -0.69 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 2' ' ' ' DT' . . . . . 0.457 ' H71' ' O ' ' A' ' 43' ' ' THR . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 101.368 -0.952 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 3' ' ' ' DT' . . . . . 0.421 " H1'" ' O ' ' A' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.408 -0.942 0 O4'-C1'-C2' 104.15 -1.772 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.794 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.519 -0.877 0 O4'-C4'-C3' 103.507 -2.093 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . 0.578 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.92 0 O4'-C4'-C3' 103.56 -2.04 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.816 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.749 0 C5'-C4'-O4' 113.042 2.276 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 101.184 -1.083 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C3'-C2'-C1' 101.373 -0.948 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 12' ' ' ' DT' . . . . . 0.43 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 101.665 -0.739 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 13' ' ' ' DT' . . . . . 0.43 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.818 0 O4'-C1'-C2' 104.419 -1.528 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.779 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 O4'-C4'-C3' 103.457 -2.143 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.532 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 O4'-C4'-C3' 103.63 -1.97 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . 0.825 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.732 0 C5'-C4'-O4' 113.114 2.321 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . 0.481 ' H72' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.425 -0.937 0 C3'-C2'-C1' 101.153 -1.105 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.8 mmm . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 121.001 0.429 . . . . 10.0 110.084 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.06 160.16 25.91 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.383 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -64.16 -49.41 72.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 10.0 110.25 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -134.55 108.32 8.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.098 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.6 tp -82.77 134.7 35.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.095 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -70.31 139.18 52.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.93 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 p90 -166.57 175.08 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.488 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -158.51 134.01 8.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.628 ' HA ' HG12 ' A' ' 30' ' ' VAL . 52.2 mt -80.79 111.82 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.9 mm -83.4 -45.96 18.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.591 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -159.31 132.43 7.04 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.107 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.0 127.44 33.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 75.9 mt -99.99 -74.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.474 -0.49 . . . . 10.0 111.931 -178.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.638 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.2 mm -130.09 144.16 38.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.086 0.469 . . . . 10.0 112.212 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.487 HG23 ' HG2' ' A' ' 26' ' ' GLU . 4.3 p -124.48 123.86 67.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.324 -0.991 . . . . 10.0 108.324 177.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.2 mt -91.02 -80.36 0.34 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.366 -0.534 . . . . 10.0 111.046 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 175.51 -177.42 0.11 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.086 0.554 . . . . 10.0 109.782 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.488 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 36.4 mp0 -97.26 164.08 12.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.38 -166.4 1.08 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -29.23 70.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.395 0.617 . . . . 10.0 109.874 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -87.91 -1.84 58.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.21 -0.905 . . . . 10.0 110.309 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.64 0.15 89.23 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.672 -0.775 . . . . 10.0 112.041 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.488 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.6 m0 -52.95 107.07 0.19 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 122.493 0.317 . . . . 10.0 111.794 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 43' ' ' THR . 14.7 tpp85 -79.97 100.28 8.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -82.59 112.75 19.76 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.751 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG2' HG23 ' A' ' 15' ' ' VAL . 45.6 mt-10 -139.25 161.67 36.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.638 0.733 . . . . 10.0 111.975 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.775 HD13 ' HB ' ' A' ' 41' ' ' ILE . 35.3 tp -130.37 108.07 9.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.569 -1.196 . . . . 10.0 108.521 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -135.62 157.38 47.01 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.832 0.349 . . . . 10.0 110.508 -178.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 29' ' ' ARG . 8.6 ttp180 -97.51 114.66 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.628 HG12 ' HA ' ' A' ' 9' ' ' ILE . 23.9 m -124.69 162.16 27.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.769 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 2.4 p -95.31 122.23 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.925 0.393 . . . . 10.0 110.635 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.1 m0 -63.86 109.46 1.76 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.768 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 60.11 29.55 19.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.931 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 t0 61.63 35.11 17.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.803 -1.09 . . . . 10.0 110.715 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.64 -76.8 0.58 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.01 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -92.48 116.16 66.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 61.3 Cg_endo -81.63 120.6 3.56 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.514 2.143 . . . . 10.0 111.049 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -149.88 159.55 44.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.686 0.279 . . . . 10.0 110.48 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.505 ' HD1' HD11 ' A' ' 13' ' ' LEU . 1.0 OUTLIER -78.68 133.95 37.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.895 -179.347 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -144.43 129.01 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.775 ' HB ' HD13 ' A' ' 27' ' ' LEU . 12.8 tt -106.13 122.44 59.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.289 0.566 . . . . 10.0 110.486 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.46 ' CZ ' ' H ' ' A' ' 54' ' ' GLY . 2.8 mtp85 -149.14 174.27 12.52 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.252 -178.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.565 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.8 p -124.19 138.44 54.41 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.625 -0.879 . . . . 10.0 108.625 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -117.89 176.92 4.98 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 121.081 -0.248 . . . . 10.0 110.987 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -66.13 150.7 96.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.365 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.04 -38.16 96.59 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.91 2.407 . . . . 10.0 112.65 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -88.11 5.7 39.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.893 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 57.86 28.05 15.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.277 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -81.03 -31.91 34.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.451 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -140.71 174.79 10.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 10.0 111.587 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.79 172.59 10.69 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.012 -0.994 . . . . 10.0 110.929 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.35 -170.26 11.81 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.734 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.431 ' HA ' ' NH2' ' A' ' 42' ' ' ARG . 22.4 mttp -103.62 141.77 35.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 10.0 112.301 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.46 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -141.0 -117.46 1.37 Allowed Glycine 0 N--CA 1.453 -0.192 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -152.78 142.12 14.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 117.381 0.591 . . . . 10.0 110.976 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 m -96.77 135.13 39.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.333 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 65.3 mt -115.02 117.44 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -78.58 169.96 17.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.567 -0.288 . . . . 10.0 110.558 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -57.38 -44.86 84.78 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.164 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.457 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 7.4 pt-20 -54.97 -45.04 74.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.854 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.457 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 34.8 mt-10 -69.26 -59.77 2.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.008 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.647 ' CE2' HD11 ' A' ' 66' ' ' LEU . 3.5 t80 -52.32 -42.15 63.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.73 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.68 -59.68 10.33 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.233 -0.508 . . . . 10.0 112.648 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 72.3 t -64.63 -41.28 91.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.99 0.424 . . . . 10.0 110.604 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.528 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.1 tp -57.67 -54.24 49.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.807 -179.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.704 ' HB3' HD11 ' B' ' 73' ' ' LEU . 17.2 mt -62.37 -43.24 99.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.702 -0.226 . . . . 10.0 111.464 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -53.43 -50.77 64.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.196 0.522 . . . . 10.0 110.733 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.625 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 41.8 mm-40 -71.5 -48.82 46.53 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.384 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.8 mt -57.37 -45.45 84.43 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.742 0.275 . . . . 10.0 111.742 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.69 -38.06 95.28 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 111.322 -0.711 . . . . 10.0 111.322 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -73.51 -25.21 60.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.869 0.366 . . . . 10.0 110.758 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.625 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.82 -29.02 68.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.883 0.373 . . . . 10.0 110.685 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.648 HD11 ' HB3' ' B' ' 66' ' ' LEU . 36.9 mt -87.72 3.14 49.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.146 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 C--O 1.252 1.184 0 CA-C-O 118.607 -0.711 . . . . 10.0 109.998 179.495 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mmm . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.916 0.389 . . . . 10.0 110.58 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.44 161.22 16.38 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.487 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.528 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 26.7 t70 -64.13 -50.26 68.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.183 0.516 . . . . 10.0 109.754 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.528 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 40.7 mmtm -135.02 109.88 8.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.672 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -83.88 135.82 34.35 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.992 -0.373 . . . . 10.0 109.992 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.405 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.2 tppt? -71.34 137.37 48.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.161 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -164.59 177.25 8.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.256 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -159.88 131.97 6.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.521 ' HA ' HG12 ' B' ' 30' ' ' VAL . 51.4 mt -78.37 108.87 12.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 10.0 110.697 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.3 mm -80.02 -50.23 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.139 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -156.51 130.75 8.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.949 -0.568 . . . . 10.0 111.237 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.08 132.14 35.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.506 HD11 ' HD1' ' B' ' 39' ' ' TYR . 57.4 mt -103.87 -71.42 0.73 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.648 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.562 HD12 ' CB ' ' A' ' 68' ' ' GLU . 19.8 mm -131.8 142.37 43.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.978 0.418 . . . . 10.0 111.946 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.431 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.8 p -124.26 121.51 61.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.277 -1.009 . . . . 10.0 108.277 177.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 37.0 mt -88.24 -80.54 0.27 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.615 -0.434 . . . . 10.0 111.489 -178.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 175.25 -178.01 0.11 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.487 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 35.3 mp0 -97.15 163.76 12.79 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.77 -164.01 0.89 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.921 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.33 -23.57 64.72 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.294 0.568 . . . . 10.0 110.3 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -93.8 -0.35 55.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.937 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.39 0.03 89.36 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.829 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.487 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.5 m0 -53.59 107.62 0.27 Allowed 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.56 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.1 tpp85 -80.46 100.2 8.39 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -81.5 113.19 19.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.857 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.431 ' HG2' HG23 ' B' ' 15' ' ' VAL . 50.5 mt-10 -139.74 162.03 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.519 0.676 . . . . 10.0 112.037 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.757 HD13 ' HB ' ' B' ' 41' ' ' ILE . 32.8 tp -131.76 107.14 8.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.725 -1.125 . . . . 10.0 108.517 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -135.5 155.95 49.68 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.634 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -96.18 114.53 26.24 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' B' ' 9' ' ' ILE . 17.0 m -122.91 162.19 23.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.443 -179.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.0 p -94.97 121.96 37.13 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.949 0.404 . . . . 10.0 110.373 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -63.63 109.92 1.84 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.661 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.405 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.9 m-80 60.54 28.14 17.81 Favored 'General case' 0 N--CA 1.462 0.14 0 O-C-N 123.781 0.676 . . . . 10.0 110.115 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.0 t70 65.91 25.29 11.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.585 -1.189 . . . . 10.0 110.982 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.74 -78.41 0.58 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.13 -0.356 . . . . 10.0 111.916 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -87.48 117.17 68.2 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.775 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 58.9 Cg_endo -82.82 119.45 2.91 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.143 1.896 . . . . 10.0 110.971 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.455 ' HE3' HG21 ' B' ' 56' ' ' THR . 12.3 ttpt -148.51 158.38 44.08 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 121.01 -0.276 . . . . 10.0 110.471 -178.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . 0.506 ' HD1' HD11 ' B' ' 13' ' ' LEU . 1.2 m-85 -78.6 133.08 37.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.457 -179.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -143.72 129.25 19.09 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.757 ' HB ' HD13 ' B' ' 27' ' ' LEU . 12.1 tt -106.67 122.5 60.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.287 0.565 . . . . 10.0 110.525 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.431 ' NH2' ' HA ' ' B' ' 53' ' ' LYS . 3.2 mtp85 -149.23 175.07 11.71 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.332 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.56 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.4 p -125.17 138.3 54.14 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.8 m-90 -117.88 176.87 5.0 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.921 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.8 m -64.99 150.79 94.76 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.581 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.39 -42.27 69.93 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.788 2.325 . . . . 10.0 112.408 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -88.36 11.75 15.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.117 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 53.48 33.35 15.89 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.563 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -84.02 -32.79 24.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.371 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -141.32 174.31 10.66 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.325 0.584 . . . . 10.0 111.351 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.27 173.05 9.58 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.711 -1.131 . . . . 10.0 110.646 -178.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.72 -169.21 11.56 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.979 -0.629 . . . . 10.0 112.578 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . 0.431 ' HA ' ' NH2' ' B' ' 42' ' ' ARG . 18.3 mttp -102.26 144.59 30.58 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.237 0.541 . . . . 10.0 112.033 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -144.18 -120.25 1.41 Allowed Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 110.73 -0.948 . . . . 10.0 110.73 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -151.65 142.38 15.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 117.309 0.555 . . . . 10.0 110.603 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.455 HG21 ' HE3' ' B' ' 38' ' ' LYS . 2.5 m -96.55 136.09 37.54 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.648 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.83 117.53 30.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.324 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.65 171.18 15.51 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.664 -0.243 . . . . 10.0 110.534 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -58.39 -44.83 89.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.98 0.419 . . . . 10.0 110.323 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.456 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.4 pt-20 -55.13 -45.03 75.58 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.894 178.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.456 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 33.5 mt-10 -70.25 -60.52 2.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.936 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.527 ' CE2' HD11 ' B' ' 66' ' ' LEU . 1.6 t80 -52.83 -38.27 61.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.658 -0.701 . . . . 10.0 111.553 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.96 -57.9 16.41 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.157 -0.544 . . . . 10.0 112.616 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 43.4 t -66.76 -40.07 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.442 . . . . 10.0 110.423 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.0 tp -58.21 -53.18 61.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.604 -0.725 . . . . 10.0 111.03 -179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.648 ' HB3' HD11 ' A' ' 73' ' ' LEU . 55.9 mt -60.3 -49.89 75.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.273 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.7 tttm -50.78 -51.58 49.16 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.464 0.477 . . . . 10.0 111.657 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.638 ' HB3' HD12 ' A' ' 14' ' ' ILE . 21.9 mm-40 -70.41 -49.2 51.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.71 -179.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.604 ' HB3' HD22 ' A' ' 66' ' ' LEU . 60.8 mt -59.81 -42.74 94.15 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.49 -39.4 97.78 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -72.88 -25.44 61.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.065 0.459 . . . . 10.0 111.037 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.6 mmtt -66.44 -29.67 69.86 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.997 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.704 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.1 mt -90.97 5.15 49.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.999 -0.28 . . . . 10.0 111.395 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 . . . . . 0 C--O 1.25 1.102 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 178.117 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.971 0.415 . . . . 10.0 110.653 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -111.11 173.22 6.44 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.56 -54.95 8.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -137.41 104.18 5.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.846 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.8 tp -73.46 145.97 45.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.164 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -76.12 131.53 39.47 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.055 0.455 . . . . 10.0 110.583 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.1 p90 -156.16 166.52 33.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.808 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.518 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.5 tp10 -150.95 124.35 8.92 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.505 -0.554 . . . . 10.0 109.505 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.2 mt -75.67 110.23 10.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.031 0.443 . . . . 10.0 110.106 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.5 mm -80.92 -43.34 20.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.43 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -164.22 128.13 2.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.972 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -76.45 135.22 39.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.587 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 95.9 mt -105.93 -74.84 0.64 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.78 -0.368 . . . . 10.0 111.809 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.665 HD12 ' HB3' ' B' ' 68' ' ' GLU . 23.8 mm -132.71 138.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.338 0.59 . . . . 10.0 112.318 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.01 119.8 59.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 107.693 -1.225 . . . . 10.0 107.693 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.491 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.7 mt -88.85 -80.85 0.28 Allowed 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.382 -0.527 . . . . 10.0 111.816 -178.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -175.67 -171.94 0.5 Allowed 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.443 -0.577 . . . . 10.0 109.443 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.7 mp0 -105.47 140.92 37.84 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -79.21 -170.78 2.4 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -26.03 68.27 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.566 0.698 . . . . 10.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.9 mttt -91.28 4.55 52.06 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.028 -0.987 . . . . 10.0 110.921 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.22 7.27 87.95 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.454 -0.879 . . . . 10.0 110.98 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -62.14 101.4 0.22 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 10.0 111.416 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.414 ' HG3' ' HG3' ' A' ' 26' ' ' GLU . 16.7 tpp85 -81.48 103.25 11.09 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.932 -0.577 . . . . 10.0 109.671 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -86.5 113.29 22.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.798 0.333 . . . . 10.0 110.153 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.414 ' HG3' ' HG3' ' A' ' 24' ' ' ARG . 61.4 mt-10 -129.93 146.94 51.64 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.353 0.597 . . . . 10.0 111.464 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.587 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 26.3 tp -114.05 108.0 16.42 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.716 -1.216 . . . . 10.0 107.716 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -134.44 152.95 52.11 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.944 0.402 . . . . 10.0 111.27 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -86.67 114.65 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.77 158.3 41.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.941 0.401 . . . . 10.0 110.828 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.518 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.9 p -97.13 125.05 41.36 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.629 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.6 m0 -64.49 108.04 1.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.652 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.3 m-80 60.03 29.06 18.66 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 123.776 0.672 . . . . 10.0 110.488 -178.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.4 t70 66.75 18.0 10.64 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.928 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.6 -79.15 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.988 -0.445 . . . . 10.0 111.918 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -97.19 124.92 47.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -178.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.3 Cg_endo -83.85 121.81 2.91 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 123.017 2.478 . . . . 10.0 111.874 178.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.585 ' HD2' HG22 ' A' ' 56' ' ' THR . 13.8 ttmm -143.98 167.24 22.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -88.42 133.54 34.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.503 0.192 . . . . 10.0 110.746 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.499 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -146.89 130.09 16.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.467 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.6 tt -104.56 122.9 58.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.499 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.2 mtt85 -142.04 -178.38 5.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -177.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -113.44 142.17 46.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.962 -1.017 . . . . 10.0 112.02 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -123.7 164.3 19.39 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.48 -0.782 . . . . 10.0 109.007 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.2 p -78.37 158.89 76.01 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.27 -20.91 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.431 2.087 . . . . 10.0 112.283 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.28 0.53 25.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.177 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 56.26 37.01 28.43 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.647 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -90.62 -39.73 12.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.274 0.559 . . . . 10.0 109.975 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -134.04 174.64 10.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.344 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -147.88 172.94 13.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.963 -177.544 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.6 -162.17 10.91 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.319 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -98.9 152.13 20.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.671 . . . . 10.0 111.694 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -140.98 -122.32 1.85 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.326 -0.71 . . . . 10.0 111.326 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.9 tt -151.65 140.84 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.265 0.555 . . . . 10.0 111.154 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.585 HG22 ' HD2' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -99.79 144.3 29.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.17 -179.894 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.84 128.62 47.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.17 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.19 163.9 26.13 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.924 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -55.6 -48.51 74.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.854 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.32 -47.64 83.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 10.0 111.076 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -61.04 -45.39 94.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.67 ' CE2' HD11 ' A' ' 66' ' ' LEU . 26.9 t80 -60.94 -45.19 95.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.268 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.33 -52.22 53.98 Favored Glycine 0 N--CA 1.451 -0.3 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.722 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.4 t -62.25 -42.27 94.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.877 0.37 . . . . 10.0 110.478 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -58.12 -54.4 47.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.794 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.67 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -63.39 -43.09 98.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.15 -0.22 . . . . 10.0 111.578 -179.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.0 tttm -52.78 -51.33 61.13 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 26.0 mm-40 -71.03 -45.32 64.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.599 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.5 mt -59.19 -43.66 92.19 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.664 0.269 . . . . 10.0 111.099 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.68 -38.31 96.22 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.574 -0.822 . . . . 10.0 111.084 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -69.68 -28.76 66.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.996 0.426 . . . . 10.0 110.491 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.9 mmtt -68.71 -30.23 68.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.07 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.492 HD11 ' HB3' ' B' ' 66' ' ' LEU . 41.8 mt -86.17 -11.44 52.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.192 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.562 -0.732 . . . . 10.0 110.835 -179.821 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.751 0.31 . . . . 10.0 110.518 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.52 175.68 5.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.4 -55.08 6.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.046 0.451 . . . . 10.0 109.865 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' B' ' 4' ' ' LYS . 13.3 mmmm -136.54 103.65 5.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.543 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.12 144.27 47.03 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.098 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.9 tppt? -75.8 128.56 35.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.331 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.9 p90 -153.52 165.84 34.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.119 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.51 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.6 tp10 -150.51 124.49 9.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.58 110.22 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.199 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -80.77 -41.49 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.335 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -164.71 129.23 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.927 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.68 137.89 39.67 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.419 -0.956 . . . . 10.0 108.419 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.564 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 95.1 mt -108.96 -73.15 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.022 -0.671 . . . . 10.0 111.997 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.502 HD12 ' CB ' ' A' ' 68' ' ' GLU . 15.3 mm -131.22 139.45 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.984 0.421 . . . . 10.0 111.848 -177.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.7 117.2 49.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 177.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -85.7 -80.8 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.798 -0.361 . . . . 10.0 111.677 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.1 m -179.21 -171.61 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 50.3 mp0 -103.08 142.77 33.55 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.131 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -81.21 -171.07 3.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.96 -0.563 . . . . 10.0 109.531 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -18.81 65.56 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.368 0.604 . . . . 10.0 110.918 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 17.7 mttt -97.84 3.99 49.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.308 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.94 6.28 86.93 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.509 -0.853 . . . . 10.0 111.293 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -62.04 102.53 0.29 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.911 0.386 . . . . 10.0 111.372 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.417 ' HG3' ' HG3' ' B' ' 26' ' ' GLU . 16.4 tpp85 -81.72 102.27 10.63 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.831 178.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.72 113.75 22.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.711 0.291 . . . . 10.0 110.299 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.417 ' HG3' ' HG3' ' B' ' 24' ' ' ARG . 53.0 mt-10 -130.87 147.67 52.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.241 0.543 . . . . 10.0 111.193 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.564 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 28.8 tp -115.22 107.87 15.86 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.908 -1.145 . . . . 10.0 107.908 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -133.72 154.11 51.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.867 0.365 . . . . 10.0 111.047 -177.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -88.05 114.19 24.42 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.361 -0.977 . . . . 10.0 108.361 178.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 16.2 m -127.37 158.1 38.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.791 0.329 . . . . 10.0 110.703 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.51 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.2 p -96.81 124.83 40.9 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.941 0.401 . . . . 10.0 110.565 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -63.97 108.68 1.56 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.574 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.477 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 61.9 m-80 58.66 30.69 20.24 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.369 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 36.0 t70 67.31 14.91 9.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.81 -1.087 . . . . 10.0 111.557 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.35 -81.35 0.47 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.053 0.39 . . . . 10.0 112.053 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -94.45 124.83 54.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.465 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 71.0 Cg_endo -83.14 124.13 3.7 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.743 2.296 . . . . 10.0 112.032 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.42 ' HB2' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -145.92 164.46 31.94 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -87.07 130.77 34.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.337 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.47 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.2 t0 -144.58 131.17 19.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.478 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.8 tt -105.22 123.0 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.47 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.9 mtp85 -142.33 -178.08 5.57 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.606 0.595 . . . . 10.0 112.606 -177.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -114.28 143.11 45.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.976 -1.011 . . . . 10.0 112.149 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 54.7 m95 -123.56 166.19 15.86 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.488 -0.778 . . . . 10.0 108.906 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -80.02 159.31 71.11 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.2 -26.1 67.96 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.578 2.186 . . . . 10.0 112.471 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -104.03 0.36 29.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.582 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER 58.84 37.29 24.89 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.577 -0.738 . . . . 10.0 111.766 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -89.87 -38.94 13.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.148 0.499 . . . . 10.0 110.384 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -134.86 174.35 10.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.321 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -147.01 173.07 12.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.929 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.98 -162.55 10.98 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.142 -0.552 . . . . 10.0 112.277 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -96.95 154.2 17.44 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.013 -0.698 . . . . 10.0 111.708 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.44 -122.62 1.77 Allowed Glycine 0 C--N 1.331 0.264 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.384 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.2 tt -152.53 139.84 13.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 117.276 0.538 . . . . 10.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.23 141.96 31.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.1 mt -124.61 126.24 45.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.157 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -73.81 164.56 26.48 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.385 -0.371 . . . . 10.0 110.149 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -58.4 -44.48 89.0 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.491 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.2 pt-20 -65.54 -43.92 88.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 10.0 110.793 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -64.82 -47.64 77.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.385 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.636 ' CE2' HD11 ' B' ' 66' ' ' LEU . 12.5 t80 -59.44 -40.22 86.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.799 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.72 -53.33 46.22 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.595 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.491 ' HB ' HD22 ' A' ' 16' ' ' LEU . 20.1 t -62.05 -42.15 93.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 120.924 0.392 . . . . 10.0 110.261 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.9 tp -58.28 -54.19 49.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.937 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.636 HD11 ' CE2' ' B' ' 62' ' ' PHE . 45.9 mt -61.17 -48.72 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.08 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -50.15 -53.86 24.71 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.75 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.665 ' HB3' HD12 ' A' ' 14' ' ' ILE . 24.3 mm-40 -69.22 -45.69 69.22 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.872 -178.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.473 HD13 ' CD2' ' A' ' 66' ' ' LEU . 70.8 mt -61.09 -42.34 98.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.612 0.244 . . . . 10.0 111.279 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.98 -38.13 96.09 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.673 -0.971 . . . . 10.0 110.673 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -70.09 -30.54 67.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.294 -0.453 . . . . 10.0 110.508 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.9 mmtt -65.65 -31.31 72.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.559 -0.291 . . . . 10.0 111.35 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.522 HD11 ' CB ' ' A' ' 66' ' ' LEU . 29.4 mt -90.36 -3.07 57.96 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.45 -0.786 . . . . 10.0 109.926 179.664 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 mmt . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.819 0.343 . . . . 10.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -93.01 169.46 10.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.698 -0.482 . . . . 10.0 109.698 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.99 -47.4 71.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.081 0.467 . . . . 10.0 110.005 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -137.51 113.92 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.148 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.5 tp -85.1 143.15 29.03 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -78.35 131.67 37.09 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.021 0.439 . . . . 10.0 110.376 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.9 p90 -152.14 171.57 17.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.798 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.543 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.2 tp10 -152.23 121.66 6.82 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.799 -0.445 . . . . 10.0 109.799 179.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.598 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.2 mt -79.37 105.7 9.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.904 0.383 . . . . 10.0 110.578 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.36 -51.96 19.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.184 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -162.72 130.54 3.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.141 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.92 144.17 41.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.664 -0.495 . . . . 10.0 109.664 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.493 ' O ' HD13 ' A' ' 14' ' ' ILE . 71.9 mt -109.28 -75.17 0.63 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.783 -0.367 . . . . 10.0 111.915 -178.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.76 HD12 ' HB3' ' B' ' 68' ' ' GLU . 32.1 mm -128.7 141.69 45.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -177.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.5 p -125.13 123.33 65.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.489 HD22 ' HB ' ' B' ' 64' ' ' VAL . 35.2 mt -92.24 -79.85 0.38 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.544 -0.462 . . . . 10.0 111.276 -178.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.09 -167.33 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.502 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.7 mp0 -108.53 145.38 34.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.769 0.318 . . . . 10.0 110.516 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -82.28 -173.46 4.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.31 -22.34 66.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.397 0.618 . . . . 10.0 110.509 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -88.62 -1.64 58.17 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.279 -0.873 . . . . 10.0 110.84 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 3.47 81.93 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.611 -0.804 . . . . 10.0 111.294 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.502 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.32 105.5 0.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.693 0.282 . . . . 10.0 111.355 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.4 tpp85 -85.47 100.31 11.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.458 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.2 mttt -82.45 115.84 21.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.617 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG2' HG23 ' A' ' 15' ' ' VAL . 83.5 mt-10 -134.68 147.31 50.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.792 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.61 HD13 ' HB ' ' A' ' 41' ' ' ILE . 35.9 tp -116.88 111.76 20.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.43 -0.805 . . . . 10.0 108.956 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -131.54 163.69 27.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 10.0 111.556 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -98.57 113.75 25.91 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.598 HG12 ' HA ' ' A' ' 9' ' ' ILE . 15.1 m -131.21 159.2 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.007 0.432 . . . . 10.0 111.269 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -96.65 125.14 40.91 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.145 178.821 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.1 m0 -63.81 108.99 1.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.525 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 58.21 31.93 21.4 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.481 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.8 t70 66.68 23.4 10.24 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 114.981 -1.009 . . . . 10.0 111.2 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.62 -88.27 0.46 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.102 -0.374 . . . . 10.0 111.745 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -95.57 124.88 51.51 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.547 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 59.6 Cg_endo -77.57 128.46 9.5 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.814 2.342 . . . . 10.0 111.851 178.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -147.94 170.06 18.52 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -94.98 131.21 41.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.213 -0.291 . . . . 10.0 110.213 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -142.42 132.01 23.91 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.61 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.5 tt -108.09 123.46 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.272 0.558 . . . . 10.0 110.059 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG2' ' HA3' ' A' ' 54' ' ' GLY . 3.4 mtt85 -145.79 177.41 8.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.133 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -124.64 142.55 51.3 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.458 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 28.7 m95 -117.56 171.14 8.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -65.55 156.92 80.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.23 -31.15 75.03 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.607 2.204 . . . . 10.0 112.618 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -97.28 2.79 51.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.178 0.513 . . . . 10.0 110.578 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 59.06 26.81 15.58 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.926 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -78.1 -37.07 47.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.116 0.484 . . . . 10.0 110.824 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -133.57 175.01 9.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.923 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.458 ' HB3' ' CE3' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -138.78 172.55 12.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.366 -0.834 . . . . 10.0 111.104 -177.088 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.85 -163.05 9.36 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.177 -0.535 . . . . 10.0 112.116 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -94.89 155.38 16.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.949 -0.736 . . . . 10.0 112.322 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.444 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.3 -127.05 1.43 Allowed Glycine 0 CA--C 1.518 0.245 0 N-CA-C 110.686 -0.966 . . . . 10.0 110.686 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -148.89 142.63 18.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 117.606 0.703 . . . . 10.0 111.198 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.47 141.15 34.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.839 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -122.09 129.4 52.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.962 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.1 m -74.23 164.97 25.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.013 -0.366 . . . . 10.0 110.013 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.47 -46.68 89.04 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.646 0.239 . . . . 10.0 111.646 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -61.96 -40.8 96.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 10.0 110.488 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.482 ' HB3' HD13 ' B' ' 16' ' ' LEU . 87.5 mt-10 -64.33 -49.79 70.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.357 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.761 ' CE2' HD11 ' A' ' 66' ' ' LEU . 15.1 t80 -57.86 -44.84 86.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.276 -0.874 . . . . 10.0 111.314 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.91 -52.16 53.88 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.284 -0.484 . . . . 10.0 112.477 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.426 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 93.0 t -63.34 -45.06 99.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 110.332 -0.247 . . . . 10.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.464 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 24.1 tp -56.19 -52.15 65.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.761 HD11 ' CE2' ' A' ' 62' ' ' PHE . 20.9 mt -62.54 -44.91 95.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.417 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.1 tttm -53.1 -52.02 59.97 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 123.567 0.542 . . . . 10.0 110.818 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 44.8 mm-40 -66.54 -51.99 50.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.428 -0.806 . . . . 10.0 111.212 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 74.2 mt -56.12 -48.32 76.43 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.184 0.439 . . . . 10.0 112.184 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.28 -39.05 96.66 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.344 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -71.23 -20.72 62.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.032 0.444 . . . . 10.0 111.117 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.691 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.7 mmtt -77.41 -26.68 51.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.601 -0.272 . . . . 10.0 110.796 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.528 HD11 ' HB3' ' B' ' 66' ' ' LEU . 24.5 mt -82.96 -19.2 37.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.996 -0.281 . . . . 10.0 111.297 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.385 -0.817 . . . . 10.0 110.887 -179.605 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.2 mmt . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.712 0.291 . . . . 10.0 110.336 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.53 168.52 11.2 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.424 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 28.9 t70 -68.85 -46.7 67.82 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.424 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 39.5 mmtm -137.19 107.7 6.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.176 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 31.1 tp -79.89 141.07 36.45 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.7 tppt? -77.35 130.17 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.249 0.547 . . . . 10.0 110.738 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -150.94 173.36 14.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.699 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.55 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.4 tp10 -154.72 122.79 5.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.617 ' HA ' HG12 ' B' ' 30' ' ' VAL . 52.9 mt -78.77 108.88 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.133 0.492 . . . . 10.0 110.784 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -78.87 -47.64 22.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.039 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -167.59 130.55 1.66 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.112 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -75.22 145.77 41.72 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 81.2 mt -112.0 -74.66 0.63 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.477 -0.489 . . . . 10.0 111.902 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.628 HD12 ' CB ' ' A' ' 68' ' ' GLU . 16.0 mm -127.24 140.8 48.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.025 0.44 . . . . 10.0 111.903 -177.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.413 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -125.93 122.48 62.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.078 -1.082 . . . . 10.0 108.078 177.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' A' ' 61' ' ' GLU . 28.8 mt -92.06 -81.29 0.34 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.373 -0.531 . . . . 10.0 111.778 -178.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -179.18 -167.71 0.11 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.484 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.15 147.55 31.12 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.348 -0.242 . . . . 10.0 110.348 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -85.15 -172.15 4.02 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.34 -20.82 66.19 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.472 0.654 . . . . 10.0 110.464 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -90.21 -2.55 58.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.177 -0.92 . . . . 10.0 110.323 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 4.52 80.85 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.484 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.7 m0 -62.33 105.99 0.69 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.748 0.308 . . . . 10.0 111.333 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.483 ' O ' ' HA ' ' B' ' 43' ' ' THR . 12.3 tpp85 -85.21 100.31 11.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.593 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.508 ' HG2' HG22 ' B' ' 43' ' ' THR . 93.9 mttt -82.06 115.73 21.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.735 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.413 ' HG2' HG23 ' B' ' 15' ' ' VAL . 90.6 mt-10 -134.23 146.61 50.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.859 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.56 HD13 ' HB ' ' B' ' 41' ' ' ILE . 42.7 tp -115.92 111.86 21.03 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.668 -0.864 . . . . 10.0 108.668 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -132.34 162.29 31.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.126 0.488 . . . . 10.0 111.623 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.1 ttm180 -97.7 113.91 25.77 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.617 HG12 ' HA ' ' B' ' 9' ' ' ILE . 22.8 m -131.55 157.12 43.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.904 0.383 . . . . 10.0 111.297 -178.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.55 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -94.19 125.3 38.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.194 178.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -63.88 109.2 1.68 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.543 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.5 m-80 58.5 32.91 22.65 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.831 0.707 . . . . 10.0 110.368 -178.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 67.63 17.79 9.9 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.946 -1.025 . . . . 10.0 111.414 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.04 -89.77 0.38 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.13 0.419 . . . . 10.0 112.13 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -90.96 123.32 65.06 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 112.271 0.471 . . . . 10.0 112.271 -177.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.541 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.87 126.75 8.98 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.831 2.354 . . . . 10.0 111.701 178.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -147.07 170.78 16.43 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -96.94 129.22 44.43 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.325 -0.25 . . . . 10.0 110.325 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.419 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.56 132.25 28.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.279 -0.638 . . . . 10.0 109.279 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.56 ' HB ' HD13 ' B' ' 27' ' ' LEU . 13.2 tt -106.82 122.7 61.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.324 0.583 . . . . 10.0 110.16 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.419 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -145.6 176.8 9.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.002 -0.544 . . . . 10.0 111.257 -178.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.508 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -123.85 142.92 50.68 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.332 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 m95 -117.15 173.37 6.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.103 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.0 m -67.87 157.79 85.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -55.44 -31.44 77.87 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.504 2.136 . . . . 10.0 112.48 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -99.3 6.08 46.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.464 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.48 28.39 15.42 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.102 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.58 -38.45 40.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.725 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -133.41 174.23 10.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.112 0.482 . . . . 10.0 111.128 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.4 172.22 13.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.165 -0.925 . . . . 10.0 111.199 -177.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.88 -161.25 8.67 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.984 -0.627 . . . . 10.0 111.797 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -97.79 153.16 18.47 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 122.17 -0.606 . . . . 10.0 112.485 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.61 -124.26 1.46 Allowed Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.403 -1.079 . . . . 10.0 110.403 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -153.16 143.25 14.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 117.549 0.675 . . . . 10.0 111.219 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.5 143.78 31.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.383 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 63.7 mt -123.19 129.08 50.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.08 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.0 m -74.59 163.09 28.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.79 -44.86 93.74 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 -178.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.485 ' O ' HG23 ' B' ' 64' ' ' VAL . 10.1 pt-20 -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.133 0.492 . . . . 10.0 110.465 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.143 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.532 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -58.01 -41.36 82.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.544 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.53 -52.84 50.52 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.06 -0.59 . . . . 10.0 112.059 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.489 ' HB ' HD22 ' A' ' 16' ' ' LEU . 28.0 t -63.96 -45.0 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 10.0 110.139 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.8 tp -55.72 -51.43 67.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.012 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 65.4 mt -61.19 -48.92 79.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.976 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 46.6 tttm -52.58 -52.54 54.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.549 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.76 ' HB3' HD12 ' A' ' 14' ' ' ILE . 51.2 mm-40 -65.94 -53.18 42.47 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.558 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.538 ' HB3' HD22 ' A' ' 66' ' ' LEU . 61.3 mt -57.96 -44.06 86.8 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.158 0.429 . . . . 10.0 112.158 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.2 -41.04 99.36 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 111.191 -0.764 . . . . 10.0 111.191 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -72.24 -22.5 61.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.314 -0.443 . . . . 10.0 111.565 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.634 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.6 mmtt -72.41 -26.55 61.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.576 HD11 ' CB ' ' A' ' 66' ' ' LEU . 22.5 mt -88.3 -5.88 58.08 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.151 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.453 -0.784 . . . . 10.0 109.884 179.716 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.223 0 CA-C-O 120.69 0.281 . . . . 10.0 110.619 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.12 164.32 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.148 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.6 -48.05 42.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.225 0.536 . . . . 10.0 109.762 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.414 ' HA ' ' HD2' ' A' ' 4' ' ' LYS . 12.8 mmmm -139.48 95.19 2.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.305 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 22.4 tp -68.93 146.33 52.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.439 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 35.3 tptt -79.37 134.83 36.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.652 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -161.87 166.73 25.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.222 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.494 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -151.8 133.07 14.49 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.635 -0.505 . . . . 10.0 109.635 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.421 ' HA ' HG12 ' A' ' 30' ' ' VAL . 72.4 mt -79.85 111.24 16.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.601 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -82.12 -45.81 19.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.056 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -164.73 127.5 2.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.839 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -80.05 142.07 35.27 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.486 ' O ' HD13 ' A' ' 14' ' ' ILE . 48.5 mt -112.12 -73.74 0.66 Allowed 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.409 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.686 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.0 mm -130.23 138.2 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.71 118.3 56.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 107.403 -1.332 . . . . 10.0 107.403 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.467 HD22 ' HB ' ' B' ' 64' ' ' VAL . 28.1 mt -85.81 -82.12 0.2 Allowed 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.138 -0.625 . . . . 10.0 111.808 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.2 m -174.97 -166.34 0.23 Allowed 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.538 -0.541 . . . . 10.0 109.538 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.4 mp0 -109.78 143.15 40.01 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.89 -0.411 . . . . 10.0 109.89 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -81.69 -171.82 3.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.79 -27.93 69.52 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.492 0.663 . . . . 10.0 110.391 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -87.55 3.2 48.43 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.031 -0.986 . . . . 10.0 111.0 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.11 6.27 88.32 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.545 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.434 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -61.9 103.71 0.38 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 10.0 111.416 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.9 tpp85 -81.26 99.53 8.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.185 178.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.486 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.0 mttt -83.96 121.04 26.84 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.957 0.408 . . . . 10.0 110.762 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -136.12 153.34 51.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.944 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.51 HD13 ' HB ' ' A' ' 41' ' ' ILE . 42.6 tp -123.02 106.96 11.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.918 . . . . 10.0 108.646 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -136.58 156.49 48.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.176 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -95.69 114.58 26.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.421 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.4 m -121.86 161.97 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.469 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.494 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -94.39 123.86 38.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.01 0.433 . . . . 10.0 110.43 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.97 108.41 1.49 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.619 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.441 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.7 m-80 60.81 27.4 17.2 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.003 -178.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.6 t70 68.62 19.57 8.57 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.938 -1.028 . . . . 10.0 110.914 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.92 -80.09 0.57 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.97 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.68 118.76 69.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -178.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.9 Cg_endo -77.95 120.3 5.0 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.621 2.214 . . . . 10.0 110.711 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.719 ' HE3' HG21 ' A' ' 56' ' ' THR . 17.3 ttpt -145.8 162.97 36.44 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.867 -0.333 . . . . 10.0 110.788 -177.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -86.57 128.32 34.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.558 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.424 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -143.03 131.46 22.24 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.51 ' HB ' HD13 ' A' ' 27' ' ' LEU . 17.9 tt -107.2 123.29 62.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.178 0.513 . . . . 10.0 110.099 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.424 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.1 mtt85 -145.32 177.6 8.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.458 -178.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.486 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -124.96 143.95 50.62 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.726 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 m95 -117.71 173.8 6.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.142 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 p -76.64 156.18 83.07 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.23 -27.62 85.49 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.726 2.284 . . . . 10.0 112.715 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -97.37 -4.58 38.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.651 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.29 34.01 16.17 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.45 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -83.93 -39.36 19.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.762 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -140.56 173.74 11.2 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.21 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.55 172.78 12.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.943 -177.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.32 -164.88 10.22 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 121.001 -0.619 . . . . 10.0 112.499 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.5 mttp -95.01 151.92 18.76 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.113 -0.639 . . . . 10.0 112.375 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.78 -128.43 1.89 Allowed Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.277 -0.874 . . . . 10.0 111.479 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -147.34 145.82 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 CA-C-N 117.727 0.764 . . . . 10.0 111.233 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.719 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.2 m -104.96 144.4 31.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.382 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.8 mt -122.43 135.16 54.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.771 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.4 m -77.46 164.51 25.37 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.127 -0.324 . . . . 10.0 110.127 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -59.39 -48.63 80.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.663 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.25 -43.57 97.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.965 0.412 . . . . 10.0 110.804 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -59.14 -48.89 79.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.246 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.651 ' CE2' HD11 ' A' ' 66' ' ' LEU . 33.5 t80 -58.06 -42.15 84.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.006 -0.997 . . . . 10.0 111.167 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.75 34.4 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.277 -0.487 . . . . 10.0 112.489 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 71.5 t -60.38 -43.7 94.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-O 120.969 0.414 . . . . 10.0 110.165 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.465 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -56.48 -52.85 63.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.542 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.691 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.5 mt -62.12 -45.67 92.43 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -52.37 -52.42 53.64 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.431 0.457 . . . . 10.0 111.19 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.576 ' CB ' HD12 ' B' ' 14' ' ' ILE . 52.1 mm-40 -68.69 -48.39 64.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.433 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.2 mt -58.97 -45.09 91.41 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.672 0.249 . . . . 10.0 111.672 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.76 -37.18 94.32 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.688 -0.767 . . . . 10.0 111.575 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -71.92 -30.06 64.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.82 0.343 . . . . 10.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 44.9 mmtt -64.63 -27.91 69.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.01 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' B' ' 66' ' ' LEU . 23.3 mt -88.75 -2.13 58.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 10.0 111.78 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.651 -179.592 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.801 0.334 . . . . 10.0 110.667 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.78 167.22 10.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.598 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -76.39 -47.94 21.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -139.46 99.2 3.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.231 -0.895 . . . . 10.0 110.102 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp -72.88 142.04 47.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.12 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.424 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 10.3 tppt? -77.15 134.39 38.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.948 0.404 . . . . 10.0 110.215 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -160.81 165.17 30.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.897 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.462 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.3 tp10 -149.24 131.96 15.95 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.401 ' HA ' HG12 ' B' ' 30' ' ' VAL . 61.2 mt -77.39 112.95 15.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.08 0.467 . . . . 10.0 110.147 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.0 mm -84.45 -42.8 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.096 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -168.35 127.99 1.22 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.644 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -81.41 140.13 34.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 55.7 mt -111.36 -67.19 1.01 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.496 -0.482 . . . . 10.0 112.244 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.576 HD12 ' CB ' ' A' ' 68' ' ' GLU . 12.0 mm -133.97 136.51 53.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 10.0 111.86 -177.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 p -120.74 120.04 61.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.233 -1.395 . . . . 10.0 107.233 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -87.04 -81.86 0.22 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.369 -0.532 . . . . 10.0 111.967 -177.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 5.4 m -177.26 -167.75 0.17 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.117 -0.697 . . . . 10.0 109.117 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.411 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 4.3 mp0 -107.07 143.48 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -82.79 -172.63 4.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.06 -25.38 68.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.31 0.576 . . . . 10.0 110.817 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -90.1 2.04 55.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.493 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.1 6.96 84.12 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.493 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.411 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.4 m0 -62.64 103.54 0.43 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.605 0.24 . . . . 10.0 111.613 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -80.35 99.98 8.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.514 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.3 mttt -84.23 119.81 25.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 10.0 110.754 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -135.5 151.59 50.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.991 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.489 HD13 ' HB ' ' B' ' 41' ' ' ILE . 39.2 tp -121.62 107.24 12.15 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -136.63 155.5 49.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.283 -178.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -94.81 115.0 26.96 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.8 m -122.26 161.68 22.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.46 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.462 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.4 p -94.34 123.49 37.78 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.273 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -63.53 109.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.448 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.424 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.4 m-80 59.06 30.9 20.82 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 123.734 0.646 . . . . 10.0 109.785 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 63.94 26.27 14.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.924 -1.035 . . . . 10.0 111.159 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.24 -78.17 0.58 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.729 -0.388 . . . . 10.0 111.755 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -88.75 117.02 67.88 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.413 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 47.9 Cg_endo -77.93 120.06 4.93 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.292 1.995 . . . . 10.0 110.481 178.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.693 ' HE3' HG21 ' B' ' 56' ' ' THR . 16.8 ttpt -146.08 164.0 33.51 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.895 -0.322 . . . . 10.0 110.442 -178.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -88.11 128.45 35.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.505 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -142.94 131.91 22.94 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.379 -0.601 . . . . 10.0 109.379 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.489 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.1 tt -107.03 123.22 62.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 121.514 0.673 . . . . 10.0 110.289 -179.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.405 ' HG2' ' HA3' ' B' ' 54' ' ' GLY . 4.1 mtt85 -145.54 177.55 8.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.394 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.514 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.47 144.49 50.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.854 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 42.0 m95 -118.06 174.03 6.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.312 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -77.3 156.65 81.38 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -30.01 87.3 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.652 2.234 . . . . 10.0 112.704 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -98.16 -2.94 38.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.934 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.03 31.38 13.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.545 -179.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -79.63 -39.18 32.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.967 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.19 174.05 10.96 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.36 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . 0.401 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -136.02 172.99 12.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 10.0 110.927 -178.147 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -136.47 -163.08 9.71 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.113 -0.565 . . . . 10.0 112.273 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -97.4 149.01 22.6 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.033 -0.686 . . . . 10.0 112.33 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.405 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -141.45 -129.11 2.43 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.342 -0.845 . . . . 10.0 111.003 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -147.82 146.68 17.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.343 0.572 . . . . 10.0 110.397 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.693 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.1 m -104.38 145.36 30.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.58 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.5 mt -123.09 133.72 54.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.691 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -76.58 164.25 26.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.11 -46.92 88.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.829 0.307 . . . . 10.0 111.829 -178.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.517 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.0 pt-20 -65.46 -41.57 93.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -61.15 -49.25 77.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.156 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.96 -39.02 80.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.629 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.18 -52.24 53.17 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.934 -0.65 . . . . 10.0 112.287 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 60' ' ' GLU . 12.1 t -63.37 -44.71 99.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 10.0 110.05 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 15.7 tp -54.87 -52.36 63.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.816 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 73' ' ' LEU . 77.9 mt -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.989 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -49.89 -53.93 22.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.642 -0.708 . . . . 10.0 111.871 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.686 ' HB3' HD12 ' A' ' 14' ' ' ILE . 13.8 mm-40 -68.84 -47.89 64.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.97 -0.559 . . . . 10.0 112.093 -178.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.691 ' HB3' HD22 ' A' ' 66' ' ' LEU . 69.0 mt -61.65 -43.53 98.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.746 0.308 . . . . 10.0 111.696 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -35.65 92.34 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.517 -0.633 . . . . 10.0 111.517 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . 0.435 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 21.1 t-20 -74.55 -27.63 60.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 10.0 110.872 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.5 mmtt -65.55 -29.04 69.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.837 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.0 mt -90.71 6.64 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.965 -0.294 . . . . 10.0 111.655 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . 0.435 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.2 mt-10 . . . . . 0 C--O 1.245 0.829 0 CA-C-O 118.197 -0.906 . . . . 10.0 110.525 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.15 155.44 17.74 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.58 -55.29 24.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 10.0 109.815 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -132.35 93.89 3.34 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.335 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 20.2 tp -65.81 150.79 48.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.355 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 15.4 tppt? -77.63 133.25 38.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.636 0.255 . . . . 10.0 110.455 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -159.14 167.95 27.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.535 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -154.11 129.48 9.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.401 ' HA ' HG12 ' A' ' 30' ' ' VAL . 49.1 mt -79.13 112.58 17.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.142 0.496 . . . . 10.0 110.704 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -79.42 -40.18 21.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.653 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -169.02 141.91 2.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.247 -0.888 . . . . 10.0 110.347 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.89 135.95 33.17 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.615 -0.883 . . . . 10.0 108.615 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 91.2 mt -104.24 -75.29 0.62 Allowed 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.573 -0.451 . . . . 10.0 111.375 -179.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.714 HD12 ' HB3' ' B' ' 68' ' ' GLU . 32.6 mm -131.68 139.22 51.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 10.0 112.074 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.9 p -122.63 125.79 73.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 107.622 -1.251 . . . . 10.0 107.622 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.481 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -93.89 -81.05 0.38 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.214 -0.595 . . . . 10.0 111.813 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.5 m -177.76 -169.78 0.23 Allowed 'General case' 0 C--O 1.237 0.4 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 -179.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.0 mp0 -104.27 140.62 37.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.374 . . . . 10.0 110.001 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -80.61 -172.0 3.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.61 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.2 -26.47 68.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.716 0.77 . . . . 10.0 110.855 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -91.65 3.93 53.89 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.736 -1.12 . . . . 10.0 111.243 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.23 5.89 89.25 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.518 -0.849 . . . . 10.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -62.95 104.05 0.51 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.928 0.394 . . . . 10.0 110.919 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.498 ' O ' ' HA ' ' A' ' 43' ' ' THR . 10.5 tpp85 -81.69 99.74 9.08 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.668 -0.696 . . . . 10.0 109.473 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.3 mttt -82.43 117.28 22.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.947 0.403 . . . . 10.0 110.713 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -131.53 148.88 52.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.165 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.558 HD13 ' HB ' ' A' ' 41' ' ' ILE . 43.2 tp -119.06 107.77 13.91 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 178.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -135.11 163.03 30.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.931 0.396 . . . . 10.0 110.746 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -98.66 114.85 27.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 9' ' ' ILE . 18.9 m -125.64 157.87 34.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 10.0 111.01 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.535 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 3.3 p -94.71 123.64 38.27 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.098 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -64.25 110.04 2.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.638 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.8 m-80 60.53 29.38 18.97 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 123.796 0.685 . . . . 10.0 110.452 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 61.83 34.37 17.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 114.692 -1.14 . . . . 10.0 110.594 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.5 -77.43 0.59 Allowed 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.26 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -88.66 115.24 62.89 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.667 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.1 Cg_endo -78.26 121.01 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.517 2.145 . . . . 10.0 111.292 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.47 ' HE3' HG21 ' A' ' 56' ' ' THR . 17.0 ttpt -149.73 163.38 38.11 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.948 -0.301 . . . . 10.0 110.698 -178.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -85.51 135.29 33.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -148.84 132.1 16.47 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.558 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.9 tt -107.21 122.11 60.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.325 0.583 . . . . 10.0 109.945 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.445 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.4 mtt85 -143.83 179.36 7.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.209 -177.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.498 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -125.9 145.18 50.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.027 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.5 m95 -117.48 173.85 6.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.214 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.5 p -78.76 159.34 74.14 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -59.47 -27.22 84.41 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.354 2.036 . . . . 10.0 112.422 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -96.11 -0.86 49.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.249 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 55.7 34.89 24.23 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.752 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -92.55 -39.8 11.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.753 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -131.58 174.29 10.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.693 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.424 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -153.4 173.1 16.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.032 -177.674 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.77 -159.56 9.25 Favored Glycine 0 C--O 1.226 -0.38 0 C-N-CA 120.941 -0.647 . . . . 10.0 111.977 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -93.65 161.33 14.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.272 0.536 . . . . 10.0 112.3 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.96 -127.28 1.3 Allowed Glycine 0 CA--C 1.519 0.333 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.974 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -147.88 143.27 19.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 117.838 0.819 . . . . 10.0 111.269 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.47 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.1 m -100.85 145.92 27.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.231 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.1 mt -125.41 127.1 46.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.849 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -76.37 163.02 27.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.008 -0.367 . . . . 10.0 110.008 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -55.9 -50.67 70.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.934 0.346 . . . . 10.0 111.934 -178.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -61.61 -46.37 90.13 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.789 0.328 . . . . 10.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -60.27 -47.82 84.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.114 0.483 . . . . 10.0 110.476 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.666 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.2 t80 -59.43 -46.82 87.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.282 -0.872 . . . . 10.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.75 -53.29 46.4 Favored Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 116.178 -0.464 . . . . 10.0 112.578 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.492 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 88.6 t -61.21 -45.55 98.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.674 0.273 . . . . 10.0 110.28 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.55 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 23.2 tp -54.66 -53.05 59.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.669 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.666 HD11 ' CE2' ' A' ' 62' ' ' PHE . 18.4 mt -62.62 -44.45 96.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.323 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -51.98 -50.35 61.45 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.063 0.459 . . . . 10.0 110.943 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.612 ' CB ' HD12 ' B' ' 14' ' ' ILE . 56.7 mm-40 -68.13 -49.53 60.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.146 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 91.1 mt -58.27 -43.86 88.16 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.662 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.09 96.5 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.335 -0.706 . . . . 10.0 111.335 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -73.08 -28.59 62.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.625 0.25 . . . . 10.0 110.72 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 70.1 mmtt -66.67 -28.0 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.644 -0.253 . . . . 10.0 111.467 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' B' ' 66' ' ' LEU . 23.1 mt -85.8 -16.24 39.41 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.096 -0.242 . . . . 10.0 111.54 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.486 -0.769 . . . . 10.0 110.715 -179.194 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 120.796 0.332 . . . . 10.0 110.169 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.41 154.55 18.97 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.04 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.431 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 19.0 t70 -62.53 -56.07 21.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.361 0.601 . . . . 10.0 109.711 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 13.3 mmmm -131.96 95.01 3.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.256 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 20.9 tp -65.77 149.5 50.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.598 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -76.51 132.99 39.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.405 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -160.09 167.5 27.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.464 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.7 tp10 -153.07 129.18 10.4 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.455 ' HA ' HG12 ' B' ' 30' ' ' VAL . 68.7 mt -78.03 111.24 14.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.348 0.594 . . . . 10.0 110.555 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 mm -78.77 -41.52 24.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.776 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -169.14 139.21 2.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.34 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.74 141.45 30.53 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 83.5 mt -111.02 -70.46 0.81 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.139 -0.624 . . . . 10.0 111.617 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.612 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.3 mm -132.86 139.61 49.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.061 0.458 . . . . 10.0 111.582 -177.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.416 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.7 p -124.62 123.61 66.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 107.807 -1.182 . . . . 10.0 107.807 177.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 41.4 mt -92.73 -81.85 0.34 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.391 -0.524 . . . . 10.0 111.803 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.34 -170.45 0.22 Allowed 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 -179.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -102.84 139.39 38.47 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -79.08 -171.46 2.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.84 -17.82 65.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.431 0.634 . . . . 10.0 111.055 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -99.3 5.87 46.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.76 3.51 90.47 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.529 -0.843 . . . . 10.0 111.181 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -61.78 104.11 0.41 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.885 0.374 . . . . 10.0 111.039 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.7 tpp85 -82.82 100.0 10.05 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.621 179.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.53 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.6 mttt -82.11 117.47 22.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.899 0.381 . . . . 10.0 110.758 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.416 ' HG2' HG23 ' B' ' 15' ' ' VAL . 58.3 mt-10 -131.67 146.78 52.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.08 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.562 HD13 ' HB ' ' B' ' 41' ' ' ILE . 44.3 tp -117.56 107.16 13.93 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -135.22 161.81 34.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.498 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -99.43 115.05 28.37 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.455 HG12 ' HA ' ' B' ' 9' ' ' ILE . 23.0 m -124.63 159.37 30.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.76 -178.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.464 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.4 p -95.8 124.01 39.63 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.306 179.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -63.84 112.64 2.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.678 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 58.63 29.46 18.55 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.472 -177.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 62.94 32.96 15.35 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.068 -0.969 . . . . 10.0 111.099 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.06 -70.7 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.95 0.352 . . . . 10.0 111.95 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -92.46 113.59 59.84 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.738 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.07 119.95 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.393 2.062 . . . . 10.0 110.753 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.559 ' HE3' HG21 ' B' ' 56' ' ' THR . 19.4 ttpt -148.9 163.9 36.08 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.709 0.29 . . . . 10.0 110.37 -178.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -87.63 135.57 33.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.922 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -149.13 132.22 16.3 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.562 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.9 tt -106.84 123.58 61.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.206 0.527 . . . . 10.0 109.855 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.428 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.7 mtt85 -144.56 179.78 7.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.234 -177.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.53 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -126.23 144.87 50.62 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.037 -0.528 . . . . 10.0 109.954 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 36.4 m95 -117.8 174.52 6.13 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.039 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -79.08 160.08 71.84 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.713 -0.477 . . . . 10.0 109.713 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.63 -27.23 84.45 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.193 1.929 . . . . 10.0 112.103 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -95.78 -4.33 44.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.272 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.06 31.81 20.76 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.117 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -89.18 -39.77 13.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.982 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -131.63 173.17 11.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.872 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . 0.421 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -150.95 172.45 15.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.772 -177.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.21 -159.72 9.42 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.318 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -93.65 156.97 16.4 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.083 -0.657 . . . . 10.0 112.262 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.62 -128.41 1.91 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.766 -0.934 . . . . 10.0 110.766 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -146.84 143.47 20.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 117.618 0.709 . . . . 10.0 110.796 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.559 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.1 m -100.83 144.52 29.68 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.771 -0.649 . . . . 10.0 111.642 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -123.62 127.29 48.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.051 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -77.03 165.98 23.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.142 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -59.82 -47.69 84.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.53 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.0 pt-20 -65.65 -43.74 88.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.897 0.38 . . . . 10.0 110.866 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 73.0 mt-10 -62.41 -47.37 84.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.414 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.42 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.0 t80 -61.96 -41.36 97.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.727 -0.67 . . . . 10.0 110.612 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.59 -53.28 47.33 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.197 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.53 HG23 ' O ' ' B' ' 60' ' ' GLU . 23.3 t -61.33 -47.47 93.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 10.0 110.216 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.5 tp -53.62 -51.62 62.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.889 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.463 ' HB3' HD11 ' A' ' 73' ' ' LEU . 56.6 mt -61.07 -48.61 80.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.139 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -52.05 -51.21 59.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.463 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.714 ' HB3' HD12 ' A' ' 14' ' ' ILE . 58.9 mm-40 -66.57 -50.73 62.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.67 -0.695 . . . . 10.0 111.582 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.658 ' HB3' HD22 ' A' ' 66' ' ' LEU . 95.6 mt -60.58 -40.74 92.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.952 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.54 -40.81 99.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.51 -0.853 . . . . 10.0 111.092 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -72.0 -28.68 63.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.644 0.259 . . . . 10.0 111.215 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -66.01 -26.45 67.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.593 0.22 . . . . 10.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.585 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.0 mt -90.07 -10.27 45.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.944 -0.303 . . . . 10.0 111.514 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.425 -0.798 . . . . 10.0 109.89 179.712 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 121.003 0.43 . . . . 10.0 110.564 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.44 172.67 7.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.024 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -74.7 -51.8 13.31 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.742 -0.466 . . . . 10.0 109.742 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.53 94.05 3.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.946 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.17 144.47 57.18 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.401 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 14.7 tppt? -78.1 130.84 36.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.932 0.396 . . . . 10.0 110.471 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -157.0 172.33 18.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.644 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.402 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.5 tp10 -154.88 134.76 12.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.417 ' HA ' HG12 ' A' ' 30' ' ' VAL . 56.4 mt -82.87 111.65 19.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 10.0 110.56 -179.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.12 -47.66 19.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.507 -0.769 . . . . 10.0 110.201 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -160.99 130.82 4.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.001 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.61 129.07 35.14 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.555 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 55.8 mt -98.95 -75.66 0.55 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.285 -0.566 . . . . 10.0 111.632 -178.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.662 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.8 mm -134.39 141.11 44.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.992 0.425 . . . . 10.0 112.029 -177.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.1 p -121.8 122.67 67.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.087 -1.079 . . . . 10.0 108.087 177.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.589 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -90.78 -80.65 0.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.303 -0.559 . . . . 10.0 111.882 -177.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -175.17 -167.62 0.28 Allowed 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.475 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 3.5 mp0 -115.84 134.77 54.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.792 0.33 . . . . 10.0 110.338 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -73.12 -174.2 1.49 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.15 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.51 -26.12 68.56 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 121.553 0.692 . . . . 10.0 110.418 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -85.24 -2.04 57.61 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.0 -1.0 . . . . 10.0 110.868 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.75 6.19 83.12 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.76 -0.936 . . . . 10.0 110.76 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.475 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.3 m0 -62.01 103.66 0.39 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.031 0.443 . . . . 10.0 111.513 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.551 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.6 tpp85 -80.88 99.1 8.16 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.29 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HG2' HG22 ' A' ' 43' ' ' THR . 90.8 mttt -83.2 113.26 20.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.064 0.459 . . . . 10.0 110.614 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.405 ' HG2' HG23 ' A' ' 15' ' ' VAL . 64.1 mt-10 -132.01 150.06 52.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.416 -0.811 . . . . 10.0 111.238 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.688 HD13 ' HB ' ' A' ' 41' ' ' ILE . 44.6 tp -117.85 109.34 16.43 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.664 -1.236 . . . . 10.0 107.664 178.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -134.76 156.94 47.97 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.087 0.47 . . . . 10.0 111.326 -177.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.1 ttm180 -96.85 114.55 26.19 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 10.0 108.781 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.417 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.8 m -126.73 159.98 35.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.8 0.334 . . . . 10.0 110.943 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.0 OUTLIER -95.62 122.99 38.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.316 179.125 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -64.47 111.43 2.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.897 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.2 m-80 59.47 29.07 18.59 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.816 0.698 . . . . 10.0 110.286 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.4 t0 66.72 24.42 9.97 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.468 -1.242 . . . . 10.0 111.143 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.69 -91.58 0.44 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.534 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -83.88 123.92 75.34 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.722 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.9 Cg_endo -82.29 122.59 3.72 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.025 2.483 . . . . 10.0 111.701 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -142.89 164.56 29.75 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.769 -0.373 . . . . 10.0 110.128 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -89.35 128.86 35.94 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -139.71 131.46 27.45 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.688 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.5 tt -108.0 121.28 60.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.521 0.676 . . . . 10.0 109.952 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.429 ' HG2' ' HA3' ' A' ' 54' ' ' GLY . 3.5 mtt85 -144.75 -178.14 5.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.069 -177.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.551 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -126.11 144.41 50.75 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.781 179.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -117.14 179.75 3.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.894 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 p -81.95 161.37 60.88 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 -32.19 93.68 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.292 1.995 . . . . 10.0 112.156 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.96 -5.96 54.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.403 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 62.12 36.26 15.25 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.545 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 50' ' ' LYS . 8.8 pt-20 -93.89 -40.48 10.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.857 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.404 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 43.6 mmtm -126.94 172.26 10.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.448 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.438 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -152.45 173.34 15.24 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.35 -177.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -134.06 -161.37 9.59 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.263 -0.97 . . . . 10.0 112.589 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -89.87 154.83 19.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.003 0.43 . . . . 10.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.429 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.35 -128.02 1.52 Allowed Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.163 -0.926 . . . . 10.0 111.156 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -143.33 143.5 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 117.755 0.777 . . . . 10.0 111.192 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.06 140.81 39.28 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.323 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.39 128.71 49.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.544 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 69.8 m -84.34 170.24 13.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.492 -0.322 . . . . 10.0 110.551 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -52.9 -51.94 59.39 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.106 0.78 . . . . 10.0 113.106 -178.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.99 -46.67 86.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.743 0.306 . . . . 10.0 111.463 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.07 -48.73 78.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.21 0.528 . . . . 10.0 110.67 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.648 ' CE2' HD11 ' A' ' 66' ' ' LEU . 32.9 t80 -61.77 -43.11 99.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.217 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.68 -52.41 53.21 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.862 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.416 ' HB ' HD22 ' B' ' 16' ' ' LEU . 58.7 t -60.62 -41.55 88.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.14 0.495 . . . . 10.0 110.083 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.7 tp -59.11 -55.25 37.42 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.422 -0.808 . . . . 10.0 110.667 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.689 HD22 ' HB3' ' B' ' 69' ' ' LEU . 16.5 mt -59.45 -47.02 87.09 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -48.86 -55.59 11.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.593 -0.73 . . . . 10.0 111.626 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.547 ' CB ' HD12 ' B' ' 14' ' ' ILE . 62.6 mm-40 -72.28 -41.99 66.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.768 -178.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.0 mt -59.66 -45.89 90.67 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.637 0.256 . . . . 10.0 111.583 -179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.06 -36.78 93.41 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.367 -0.921 . . . . 10.0 111.076 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -67.55 -25.0 65.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 10.0 110.891 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.7 mmtt -72.37 -26.88 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.447 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.484 HD11 ' HB3' ' B' ' 66' ' ' LEU . 35.2 mt -88.14 -18.74 28.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.637 0.256 . . . . 10.0 111.009 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.594 -0.717 . . . . 10.0 111.044 -179.529 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.897 0.38 . . . . 10.0 110.425 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.82 167.06 10.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.403 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 31.6 t70 -70.82 -53.98 13.29 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.403 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 20.7 mmtm -132.76 94.26 3.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.835 179.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 27.2 tp -65.57 142.23 58.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.808 0.337 . . . . 10.0 110.268 179.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.9 tppt? -75.26 126.98 32.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.58 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -153.01 171.69 17.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.914 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.531 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.7 tp10 -155.15 132.01 10.73 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.435 ' HA ' HG12 ' B' ' 30' ' ' VAL . 53.4 mt -81.22 114.46 22.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.203 0.525 . . . . 10.0 110.633 -179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.1 mm -86.42 -41.0 14.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -166.17 130.04 2.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.651 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.86 132.24 39.05 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.736 -0.838 . . . . 10.0 108.736 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 29.3 mt -102.97 -72.91 0.68 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.384 -0.526 . . . . 10.0 111.76 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.547 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.0 mm -136.66 137.94 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.918 0.389 . . . . 10.0 112.016 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 p -119.0 122.98 70.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . 0.416 HD22 ' HB ' ' A' ' 64' ' ' VAL . 38.6 mt -90.67 -80.34 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.599 -0.44 . . . . 10.0 111.433 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -177.06 -167.18 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.3 mt-10 -115.78 136.43 53.06 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.924 -0.398 . . . . 10.0 109.924 179.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -74.14 -175.35 2.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.214 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.83 -25.64 68.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.289 0.566 . . . . 10.0 110.751 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -86.12 0.51 53.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.52 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 6.36 85.14 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.284 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.501 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -62.5 104.31 0.5 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.971 0.415 . . . . 10.0 111.705 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.538 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.2 tpp85 -80.56 99.57 8.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.272 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.605 ' HG2' HG22 ' B' ' 43' ' ' THR . 91.5 mttt -83.2 114.09 21.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.969 0.414 . . . . 10.0 110.798 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -133.67 151.56 51.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.756 HD13 ' HB ' ' B' ' 41' ' ' ILE . 48.3 tp -119.01 109.07 15.51 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.539 -1.282 . . . . 10.0 107.539 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -133.95 156.59 47.87 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.152 0.501 . . . . 10.0 111.209 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -96.71 114.33 25.96 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' B' ' 9' ' ' ILE . 14.5 m -126.65 160.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.86 0.362 . . . . 10.0 110.86 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.531 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -96.53 123.02 40.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.371 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -64.07 111.23 2.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.903 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.421 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 66.2 m-80 60.12 29.32 18.91 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.064 -178.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.8 t70 69.38 16.04 8.35 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.176 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.15 -93.56 0.32 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.164 0.431 . . . . 10.0 112.164 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -80.03 122.62 83.32 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.792 0.33 . . . . 10.0 111.751 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 82.9 Cg_endo -82.16 124.38 4.3 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.894 2.396 . . . . 10.0 111.591 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -143.78 165.69 26.98 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -91.14 128.7 37.06 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t0 -139.15 130.19 26.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.756 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.2 tt -106.18 121.55 58.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 121.441 0.638 . . . . 10.0 109.934 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.445 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.1 mtt85 -144.88 -178.07 5.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.257 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.605 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.85 144.77 50.52 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.123 -0.489 . . . . 10.0 109.937 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -117.41 179.54 4.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.12 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.73 161.75 57.59 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.42 -35.28 96.19 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.312 2.008 . . . . 10.0 112.082 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -89.17 -5.47 57.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.549 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.55 37.24 16.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.898 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -94.04 -39.7 10.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.632 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -128.77 169.87 14.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.015 0.436 . . . . 10.0 110.942 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . 0.407 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -149.68 172.83 14.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.343 -177.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.72 -162.83 10.19 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.959 -0.638 . . . . 10.0 112.212 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -89.11 153.45 20.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.202 0.525 . . . . 10.0 112.197 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.435 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -147.32 -128.73 1.87 Allowed Glycine 0 C--N 1.331 0.282 0 N-CA-C 110.645 -0.982 . . . . 10.0 110.645 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -143.37 141.97 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 117.665 0.733 . . . . 10.0 111.13 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.11 142.25 35.22 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.254 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -125.76 126.45 44.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.582 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.9 m -79.92 171.52 15.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.25 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -55.85 -52.51 63.78 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.301 0.482 . . . . 10.0 112.301 -178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.589 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.3 pt-20 -60.88 -44.59 96.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.787 0.327 . . . . 10.0 111.447 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -64.39 -49.59 71.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.001 0.429 . . . . 10.0 110.848 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -62.65 -39.32 93.51 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.908 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.97 -54.02 40.92 Favored Glycine 0 C--N 1.328 0.128 0 C-N-CA 121.163 -0.541 . . . . 10.0 112.961 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.589 ' HB ' HD22 ' A' ' 16' ' ' LEU . 13.0 t -61.36 -39.68 83.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.161 0.505 . . . . 10.0 109.904 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.0 tp -59.87 -55.11 38.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.278 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.484 ' HB3' HD11 ' A' ' 73' ' ' LEU . 75.5 mt -58.03 -49.47 76.74 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.212 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.7 tttm -49.14 -57.18 7.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.016 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.662 ' HB3' HD12 ' A' ' 14' ' ' ILE . 65.5 mm-40 -70.48 -42.91 70.77 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.24 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.689 ' HB3' HD22 ' A' ' 66' ' ' LEU . 49.0 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.609 0.226 . . . . 10.0 111.609 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.95 -35.66 92.29 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . 0.41 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 10.6 t-20 -70.3 -27.26 64.25 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.951 0.405 . . . . 10.0 111.143 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 52.1 mmtt -69.0 -27.11 65.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.594 -0.276 . . . . 10.0 111.59 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 66' ' ' LEU . 27.6 mt -89.91 -5.81 56.39 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.774 -0.37 . . . . 10.0 111.63 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . 0.41 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.2 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.663 -0.684 . . . . 10.0 110.362 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.622 0.249 . . . . 10.0 110.749 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.14 150.25 25.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.519 -0.548 . . . . 10.0 109.519 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.461 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 36.8 t70 -63.35 -41.16 98.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.846 0.355 . . . . 10.0 110.574 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 21.3 mmtm -135.79 103.56 5.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.062 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.0 tp -87.31 142.2 28.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -75.28 126.32 30.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.29 0.567 . . . . 10.0 110.744 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.3 p90 -146.34 169.71 18.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.637 -0.711 . . . . 10.0 109.154 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.487 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.0 tp10 -153.84 122.1 6.14 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.443 ' HA ' HG12 ' A' ' 30' ' ' VAL . 64.4 mt -73.23 112.97 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.078 0.466 . . . . 10.0 110.362 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -85.16 -42.76 16.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.144 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -165.48 134.23 3.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.853 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -85.71 133.25 34.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.4 mt -102.15 -75.8 0.59 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.5 -0.48 . . . . 10.0 111.9 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.65 HD12 ' HB3' ' B' ' 68' ' ' GLU . 35.6 mm -131.74 137.27 55.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.568 0.581 . . . . 10.0 112.568 -177.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.426 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.0 p -116.31 120.68 65.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.219 -1.03 . . . . 10.0 108.219 177.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.3 mt -87.77 -81.44 0.24 Allowed 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.386 -0.526 . . . . 10.0 111.768 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m -178.29 -168.69 0.16 Allowed 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.63 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 14.8 mp0 -114.48 139.04 49.87 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.204 0.315 . . . . 10.0 110.924 179.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -76.1 -171.81 1.82 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.318 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.92 -26.45 68.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.311 0.577 . . . . 10.0 111.173 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -88.51 1.8 54.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.361 -0.836 . . . . 10.0 111.133 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.24 4.38 88.16 Favored Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.68 ' HB3' HG21 ' A' ' 43' ' ' THR . 37.9 m0 -57.74 107.96 0.51 Allowed 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.259 -0.47 . . . . 10.0 111.911 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.9 tpp85 -86.86 104.86 16.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.889 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.539 ' CG ' HG23 ' A' ' 43' ' ' THR . 83.3 mttt -91.68 117.41 29.72 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.277 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.426 ' HG2' HG23 ' A' ' 15' ' ' VAL . 58.2 mt-10 -135.55 147.86 48.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.466 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.755 HD13 ' HB ' ' A' ' 41' ' ' ILE . 39.4 tp -114.02 108.18 16.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.11 -0.95 . . . . 10.0 108.578 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -135.1 169.24 17.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.933 0.397 . . . . 10.0 110.832 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.446 ' HD3' ' CE1' ' A' ' 39' ' ' TYR . 10.0 ttp180 -108.86 118.01 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.9 m -127.16 161.33 34.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.724 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.487 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.8 p -96.48 123.58 40.19 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.217 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.4 109.25 1.86 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.714 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 62.1 23.96 14.2 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.301 0.572 . . . . 10.0 109.826 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t0 66.6 23.68 10.3 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.521 -1.218 . . . . 10.0 111.088 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.47 -79.64 0.52 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.901 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -98.32 125.05 44.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.583 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.0 Cg_endo -82.21 125.88 4.74 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.801 2.334 . . . . 10.0 111.66 178.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.2 ttmm -146.38 163.92 34.08 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.446 ' CE1' ' HD3' ' A' ' 29' ' ' ARG . 7.6 m-85 -84.68 129.65 34.81 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.188 -0.301 . . . . 10.0 110.188 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.465 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -143.32 127.32 17.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.755 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -105.09 123.41 59.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 CA-C-O 121.154 0.502 . . . . 10.0 109.729 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.465 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtp85 -142.91 -179.17 6.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.389 0.614 . . . . 10.0 112.27 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.68 HG21 ' HB3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -124.26 135.75 53.64 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.715 -1.129 . . . . 10.0 110.404 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -122.37 165.34 16.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.721 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -67.98 152.53 96.34 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.121 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.19 -35.88 95.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.85 2.367 . . . . 10.0 113.109 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.48 -4.92 59.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.949 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 63.0 28.94 16.43 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.833 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.419 ' H ' ' HG2' ' A' ' 49' ' ' GLU . 9.7 pt-20 -79.18 -35.41 41.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.705 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.3 mmmm -141.08 174.55 10.41 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.328 0.585 . . . . 10.0 111.63 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.57 168.06 19.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.888 -1.051 . . . . 10.0 110.889 -178.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.38 -171.77 12.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.056 -0.593 . . . . 10.0 112.144 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.7 mttp -90.97 151.62 21.01 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.154 -0.615 . . . . 10.0 111.838 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.07 -123.48 1.44 Allowed Glycine 0 C--N 1.333 0.398 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.6 141.07 15.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 121.366 0.603 . . . . 10.0 111.751 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.72 143.41 30.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.75 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.5 mt -119.77 128.4 53.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.378 -0.373 . . . . 10.0 110.258 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.8 m -76.16 162.93 27.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -56.64 -48.66 77.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.024 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -64.26 -43.39 95.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.004 0.431 . . . . 10.0 110.717 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.15 -51.89 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.289 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.41 -36.75 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.65 -52.49 52.16 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 121.201 -0.523 . . . . 10.0 112.032 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.1 t -64.63 -41.96 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.957 0.408 . . . . 10.0 110.075 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.447 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 13.0 tp -56.46 -52.86 63.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.443 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.872 ' HB3' HD11 ' B' ' 73' ' ' LEU . 19.0 mt -62.07 -47.04 86.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.917 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -50.48 -52.91 33.93 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.558 0.536 . . . . 10.0 111.115 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 7.5 mm-40 -70.35 -51.51 29.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.649 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.482 ' HB3' HD22 ' B' ' 66' ' ' LEU . 72.8 mt -55.37 -45.89 76.53 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -178.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.48 -39.27 97.08 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.688 -0.768 . . . . 10.0 111.34 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -72.89 -26.77 61.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.82 0.343 . . . . 10.0 110.882 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.662 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 40.5 mmtt -67.32 -30.21 69.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.548 -0.296 . . . . 10.0 110.479 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' B' ' 66' ' ' LEU . 26.0 mt -77.34 -22.2 52.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.274 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.629 -0.7 . . . . 10.0 110.389 -179.714 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.965 0.412 . . . . 10.0 110.315 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.39 150.77 23.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.22 -0.446 . . . . 10.0 109.817 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 29.0 t70 -63.79 -41.34 97.95 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.116 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.456 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 31.1 mmtm -134.35 104.82 6.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.952 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 23.7 tp -88.2 141.4 28.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 28.4 tptt -75.81 124.66 27.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.418 0.628 . . . . 10.0 110.66 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -144.58 168.37 20.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.22 -0.9 . . . . 10.0 108.839 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.476 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 12.7 tp10 -151.68 119.71 6.25 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.615 ' HA ' HG12 ' B' ' 30' ' ' VAL . 63.8 mt -70.86 110.79 4.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.066 0.46 . . . . 10.0 110.275 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 34.7 mm -83.44 -43.45 18.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.278 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -164.08 132.92 3.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.953 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -83.9 135.04 34.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 62.7 mt -105.51 -74.74 0.64 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.547 -0.461 . . . . 10.0 111.845 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.522 HD12 ' CB ' ' A' ' 68' ' ' GLU . 17.5 mm -130.77 137.23 56.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.434 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.5 p -117.56 118.14 57.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.168 -1.049 . . . . 10.0 108.168 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -86.68 -81.69 0.22 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.441 -0.504 . . . . 10.0 111.716 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.68 -168.83 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.835 0.454 . . . . 10.0 109.81 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.634 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 15.7 mp0 -113.59 141.53 47.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.517 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -76.98 -169.41 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.764 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.21 -20.71 64.86 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.142 0.496 . . . . 10.0 111.041 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -91.51 1.32 57.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.694 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.46 3.01 84.63 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.006 -0.838 . . . . 10.0 111.006 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.681 ' HB3' HG21 ' B' ' 43' ' ' THR . 38.1 m0 -57.07 108.96 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.315 -0.443 . . . . 10.0 112.152 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.2 tpp85 -87.5 105.52 17.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.132 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.527 ' HG2' HG23 ' B' ' 43' ' ' THR . 70.2 mttt -91.82 116.47 28.93 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.945 0.402 . . . . 10.0 110.465 179.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.434 ' HG2' HG23 ' B' ' 15' ' ' VAL . 57.2 mt-10 -134.51 146.87 50.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.069 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.8 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.4 tp -113.73 108.41 17.07 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -134.89 169.1 17.9 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.856 0.36 . . . . 10.0 110.736 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.535 ' HD3' ' CE1' ' B' ' 39' ' ' TYR . 14.3 ttp180 -108.94 115.63 30.44 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.615 HG12 ' HA ' ' B' ' 9' ' ' ILE . 25.5 m -125.14 161.74 28.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.751 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.2 p -96.56 123.82 40.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.319 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.02 110.06 2.01 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.292 -0.632 . . . . 10.0 109.292 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.427 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.44 26.95 16.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.479 0.656 . . . . 10.0 110.039 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 39.2 t0 63.27 25.46 14.74 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.623 -1.171 . . . . 10.0 110.839 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -78.85 0.56 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.767 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -99.08 122.59 51.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-O 120.697 0.284 . . . . 10.0 111.666 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.5 Cg_endo -80.14 126.97 6.56 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.922 2.414 . . . . 10.0 112.027 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.428 ' HD2' HG22 ' B' ' 56' ' ' THR . 18.1 ttmm -148.1 165.27 31.34 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . 0.535 ' CE1' ' HD3' ' B' ' 29' ' ' ARG . 7.0 m-85 -85.64 128.78 34.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.268 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 11.3 t0 -143.04 127.46 17.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.8 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.9 tt -105.47 123.28 59.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.442 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 4.8 mtp85 -143.12 -179.22 6.25 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.407 0.622 . . . . 10.0 112.373 -177.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.681 HG21 ' HB3' ' B' ' 23' ' ' TRP . 0.2 OUTLIER -123.73 136.72 54.61 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.263 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -122.5 166.39 14.86 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.624 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -69.69 152.52 96.14 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 10.0 109.953 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.02 -40.46 81.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.926 2.418 . . . . 10.0 113.0 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -84.98 -5.26 59.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 10.0 110.859 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 66.27 24.3 10.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.375 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -72.02 -38.93 69.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.823 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -138.5 174.55 10.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.467 0.651 . . . . 10.0 111.853 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.49 166.98 21.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.671 -1.15 . . . . 10.0 110.631 -178.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.2 -169.28 12.39 Favored Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.126 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -92.33 146.92 23.33 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.169 -0.606 . . . . 10.0 111.914 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.404 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -141.22 -125.31 2.1 Favored Glycine 0 N--CA 1.453 -0.221 0 N-CA-C 110.7 -0.96 . . . . 10.0 110.7 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.1 tt -151.93 139.47 13.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 117.684 0.742 . . . . 10.0 111.55 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.428 HG22 ' HD2' ' B' ' 38' ' ' LYS . 0.9 OUTLIER -98.54 141.47 31.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.887 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 76.5 mt -118.45 129.32 55.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.486 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.7 m -73.67 164.58 26.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -60.08 -48.21 82.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.467 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.426 ' O ' HG23 ' B' ' 64' ' ' VAL . 14.7 pt-20 -63.53 -41.0 98.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.041 0.448 . . . . 10.0 110.739 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -63.49 -53.22 55.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.918 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.41 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.8 t80 -61.08 -36.78 80.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.291 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.51 -52.7 50.97 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.204 -0.522 . . . . 10.0 112.102 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.426 HG23 ' O ' ' B' ' 60' ' ' GLU . 60.5 t -64.02 -43.22 97.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.043 0.449 . . . . 10.0 109.887 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.52 -52.7 62.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.569 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.51 ' HB3' HD11 ' A' ' 73' ' ' LEU . 44.0 mt -60.6 -49.57 77.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.462 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -50.09 -54.07 22.97 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 123.523 0.515 . . . . 10.0 111.363 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.65 ' HB3' HD12 ' A' ' 14' ' ' ILE . 6.3 mm-40 -69.19 -52.98 22.45 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.655 -178.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.595 ' HB3' HD22 ' A' ' 66' ' ' LEU . 61.0 mt -56.36 -44.57 80.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.98 -38.62 95.79 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.972 -0.633 . . . . 10.0 111.644 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . 0.468 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.1 t-20 -75.67 -23.07 56.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.806 0.336 . . . . 10.0 111.013 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.1 mmtt -69.83 -26.07 64.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.507 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.872 HD11 ' HB3' ' A' ' 66' ' ' LEU . 22.0 mt -84.85 -12.57 53.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.974 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . 0.468 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.9 mt-10 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.619 -0.705 . . . . 10.0 110.246 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 mmt . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.83 0.348 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.0 171.86 7.25 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.499 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 34.3 t70 -71.15 -50.61 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.9 -0.408 . . . . 10.0 109.9 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 45.8 mmtm -140.66 120.86 13.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.668 178.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.3 tp -92.87 138.74 31.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -72.03 128.71 36.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.459 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -156.11 163.17 39.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.483 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 6.7 tp10 -145.64 134.57 22.52 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.262 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.3 mt -84.3 110.36 18.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.402 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 41.2 mm -78.52 -47.62 23.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.763 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -162.32 134.62 5.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.905 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.62 137.26 37.76 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 72.2 mt -106.32 -75.94 0.62 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.157 -0.617 . . . . 10.0 111.44 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.612 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.5 mm -132.93 139.35 49.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -177.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.416 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -117.04 125.72 74.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 107.805 -1.183 . . . . 10.0 107.805 177.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.534 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.8 mt -95.66 -81.12 0.41 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.984 -0.686 . . . . 10.0 112.033 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 m -176.35 -165.18 0.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 17.9 mt-10 -117.43 143.73 45.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.855 0.36 . . . . 10.0 110.53 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -80.21 -176.68 5.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.678 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.57 -21.43 66.34 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.607 0.718 . . . . 10.0 110.711 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -87.23 -6.31 58.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.087 -0.961 . . . . 10.0 110.556 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.23 3.46 72.6 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.076 -0.81 . . . . 10.0 111.076 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.563 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.4 m0 -60.77 108.15 0.81 Allowed 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.742 -0.229 . . . . 10.0 111.345 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.8 tpp85 -84.05 100.26 10.98 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.642 ' HG2' HG22 ' A' ' 43' ' ' THR . 80.0 mttt -84.51 114.15 21.74 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.75 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.416 ' HG2' HG23 ' A' ' 15' ' ' VAL . 73.3 mt-10 -134.06 147.73 50.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.875 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.708 HD13 ' HB ' ' A' ' 41' ' ' ILE . 37.2 tp -115.34 110.56 19.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.232 -0.895 . . . . 10.0 108.623 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.57 159.31 40.84 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.051 0.453 . . . . 10.0 111.304 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -95.75 113.94 25.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.9 m -126.85 159.33 36.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.94 0.4 . . . . 10.0 110.868 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.3 p -96.8 123.72 40.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.471 179.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.5 m0 -63.62 108.64 1.44 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.489 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.3 m-80 59.61 28.93 18.45 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.107 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 63.67 26.9 14.7 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 114.927 -1.033 . . . . 10.0 111.229 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.88 -70.49 0.79 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.646 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 40.1 tt0 -95.12 112.83 59.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.573 -0.285 . . . . 10.0 111.726 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 6.3 Cg_exo -77.06 120.38 5.39 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.018 2.479 . . . . 10.0 110.909 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.577 ' HE3' HG21 ' A' ' 56' ' ' THR . 19.5 ttpt -148.89 166.55 28.23 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.733 -0.387 . . . . 10.0 110.61 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -90.26 134.48 34.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.64 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.57 132.97 18.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.708 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.9 tt -109.78 122.84 65.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 121.321 0.581 . . . . 10.0 109.802 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.2 mtt85 -144.9 179.73 7.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.197 -178.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.642 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -125.1 144.21 50.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.256 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -117.78 171.03 8.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.798 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 m -70.28 157.55 89.65 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.92 -29.22 88.91 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.248 1.965 . . . . 10.0 112.016 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -94.34 -1.07 54.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.811 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 61.78 27.01 16.47 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.127 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -76.81 -36.19 57.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.417 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -139.25 174.66 10.28 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.52 0.676 . . . . 10.0 112.304 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.93 172.93 12.28 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.337 -1.301 . . . . 10.0 110.302 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -143.09 -167.38 11.53 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 120.852 -0.69 . . . . 10.0 111.969 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -93.36 147.53 22.86 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.029 -0.689 . . . . 10.0 112.241 -179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.24 -117.89 1.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.576 -1.01 . . . . 10.0 110.576 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.29 141.27 15.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 117.348 0.574 . . . . 10.0 111.031 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.577 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.2 m -101.85 141.32 34.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.595 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.5 mt -119.28 129.41 54.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.164 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 t -79.5 168.35 19.56 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.854 -0.425 . . . . 10.0 109.854 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -58.39 -50.5 73.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.075 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.18 -41.91 98.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.041 0.448 . . . . 10.0 110.886 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.19 -54.02 44.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.016 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.691 ' CE2' HD11 ' A' ' 66' ' ' LEU . 33.1 t80 -56.78 -43.16 80.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.352 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.28 -52.5 52.89 Favored Glycine 0 CA--C 1.519 0.292 0 C-N-CA 121.327 -0.463 . . . . 10.0 113.155 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.73 -42.56 95.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.861 0.362 . . . . 10.0 110.482 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.456 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.4 tp -56.25 -51.35 68.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.804 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.703 HD22 ' HB3' ' B' ' 69' ' ' LEU . 21.5 mt -62.67 -46.61 87.37 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.467 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.9 tttm -50.83 -54.46 23.58 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.705 0.628 . . . . 10.0 111.352 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.579 ' CB ' HD12 ' B' ' 14' ' ' ILE . 9.2 mm-40 -66.9 -51.23 57.93 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.801 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 81.8 mt -57.5 -45.84 84.46 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.54 -39.37 97.56 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.884 -0.674 . . . . 10.0 111.767 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -68.6 -27.47 66.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.625 0.25 . . . . 10.0 111.142 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 75.3 mmtt -69.59 -28.71 66.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.866 0.365 . . . . 10.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' B' ' 66' ' ' LEU . 32.2 mt -89.67 -2.84 58.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.323 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.656 -179.608 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 23.7 mmt . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.834 0.35 . . . . 10.0 110.144 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.31 167.55 9.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.065 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.465 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 38.0 t70 -66.79 -54.33 23.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.141 0.496 . . . . 10.0 110.026 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.465 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 42.9 mmtm -139.44 118.07 12.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.349 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.8 tp -89.03 138.65 31.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.662 0.268 . . . . 10.0 110.494 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.0 tppt? -72.1 128.34 35.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.591 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -156.49 163.57 39.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.141 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -147.29 136.35 22.34 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.747 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -84.54 111.76 20.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.678 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.51 -45.33 23.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.176 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -165.47 131.53 2.66 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.478 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.4 139.95 41.15 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.527 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 70.0 mt -109.92 -73.69 0.68 Allowed 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.203 -0.599 . . . . 10.0 111.936 -178.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.579 HD12 ' CB ' ' A' ' 68' ' ' GLU . 16.4 mm -132.49 138.01 53.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.42 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.5 p -117.48 122.43 69.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 49.0 mt -93.25 -81.31 0.36 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.274 -0.57 . . . . 10.0 112.32 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.4 m -176.22 -166.45 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.562 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 48.6 mt-10 -117.91 140.24 49.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.684 0.278 . . . . 10.0 110.526 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -75.83 -176.01 3.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.057 -0.519 . . . . 10.0 109.927 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.9 -16.84 64.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.416 0.627 . . . . 10.0 110.785 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -91.84 -4.79 54.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.375 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.7 2.07 73.0 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.621 -0.8 . . . . 10.0 111.412 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.562 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.0 m0 -59.45 107.05 0.52 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 120.805 0.335 . . . . 10.0 111.537 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.6 tpp85 -82.96 100.2 10.27 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.655 ' HG2' HG22 ' B' ' 43' ' ' THR . 79.3 mttt -84.7 114.05 21.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.883 -179.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.42 ' HG2' HG23 ' B' ' 15' ' ' VAL . 64.8 mt-10 -135.22 147.4 49.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.681 . . . . 10.0 110.992 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.663 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.0 tp -114.4 110.76 20.38 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.258 -0.883 . . . . 10.0 108.906 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.73 158.94 42.03 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.038 0.446 . . . . 10.0 111.069 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -95.36 113.71 25.41 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 m -126.44 161.16 33.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.901 0.382 . . . . 10.0 110.778 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.479 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -98.52 124.24 43.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.565 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -64.08 108.13 1.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.573 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.403 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.07 29.5 19.06 Favored 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 123.783 0.677 . . . . 10.0 109.896 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 27.9 t70 63.19 22.11 13.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 114.615 -1.175 . . . . 10.0 111.299 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.14 -66.6 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.035 -0.415 . . . . 10.0 111.785 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.44 112.13 61.59 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.479 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 56.5 Cg_endo -77.18 120.19 5.27 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.219 1.946 . . . . 10.0 110.872 178.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.536 ' HE3' HG21 ' B' ' 56' ' ' THR . 16.9 ttpt -147.81 170.39 17.72 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.014 -0.274 . . . . 10.0 110.509 -178.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -93.55 133.52 36.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.673 -0.24 . . . . 10.0 110.686 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.409 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -147.11 132.2 18.28 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.663 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.7 tt -108.08 122.72 62.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.275 0.56 . . . . 10.0 109.907 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.409 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.6 mtt85 -145.33 177.15 9.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.377 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.655 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -122.14 144.09 49.15 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.29 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 38.2 m95 -118.01 171.66 7.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.71 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.1 m -70.8 158.06 88.85 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -59.61 -29.5 90.0 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.179 1.919 . . . . 10.0 111.691 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.96 -3.29 51.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.869 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 61.49 29.96 18.6 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.744 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.29 -34.6 31.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.166 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mmtm -137.56 174.28 10.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.321 0.581 . . . . 10.0 112.113 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.72 172.4 12.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.085 -178.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -141.95 -164.23 9.96 Favored Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.631 -0.795 . . . . 10.0 112.195 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -96.8 143.44 27.72 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.095 -0.65 . . . . 10.0 112.139 -179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.405 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -136.55 -118.49 1.76 Allowed Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 110.338 -1.105 . . . . 10.0 110.338 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -152.4 141.38 14.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 117.59 0.695 . . . . 10.0 110.926 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.536 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.2 m -100.47 142.29 32.14 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.673 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 71.6 mt -120.41 128.78 53.52 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.19 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -77.36 169.23 18.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.29 -48.43 81.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.632 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.607 ' O ' HG23 ' B' ' 64' ' ' VAL . 10.6 pt-20 -62.37 -44.3 96.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.055 0.455 . . . . 10.0 110.486 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -61.31 -54.11 48.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.614 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.413 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -58.05 -40.47 81.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.687 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.55 -51.55 58.15 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 116.024 -0.535 . . . . 10.0 112.552 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.607 HG23 ' O ' ' B' ' 60' ' ' GLU . 15.1 t -65.74 -44.67 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 120.801 0.334 . . . . 10.0 110.387 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.0 -51.75 65.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.919 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 73' ' ' LEU . 95.9 mt -60.48 -51.1 70.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.144 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.07 -57.61 5.58 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.758 0.661 . . . . 10.0 112.142 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.612 ' HB3' HD12 ' A' ' 14' ' ' ILE . 9.3 mm-40 -65.85 -50.39 64.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.068 -0.514 . . . . 10.0 112.146 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.703 ' HB3' HD22 ' A' ' 66' ' ' LEU . 78.6 mt -59.59 -44.97 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -178.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.69 -37.45 94.81 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.188 -0.529 . . . . 10.0 111.921 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -71.94 -27.34 62.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.818 0.342 . . . . 10.0 111.147 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.2 mmtt -66.07 -34.17 77.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.646 0.26 . . . . 10.0 111.051 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.469 HD11 ' CB ' ' A' ' 66' ' ' LEU . 23.6 mt -90.64 8.81 32.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.606 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.242 -0.885 . . . . 10.0 110.575 -180.0 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 CA-C-O 120.757 0.313 . . . . 10.0 110.895 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.3 158.2 16.78 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.076 -0.342 . . . . 10.0 110.076 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.408 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 7.1 t70 -61.53 -50.06 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 10.0 110.392 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 40.7 mmtm -136.47 100.45 4.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.48 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.9 tp -75.61 140.52 42.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.44 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.8 tppt? -75.75 136.14 40.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.91 0.386 . . . . 10.0 110.937 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -158.92 174.85 14.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.506 -0.553 . . . . 10.0 109.506 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.463 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.0 tp10 -156.58 129.13 7.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.732 -0.469 . . . . 10.0 109.732 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.461 ' HA ' HG12 ' A' ' 30' ' ' VAL . 61.1 mt -80.75 119.02 29.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.945 0.402 . . . . 10.0 110.625 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.9 mm -90.33 -48.63 14.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.287 0.565 . . . . 10.0 110.204 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -162.38 128.43 3.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.865 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -74.72 144.65 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.844 -0.799 . . . . 10.0 108.844 178.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 80.4 mt -114.1 -72.98 0.67 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.579 -0.448 . . . . 10.0 112.096 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.649 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.3 mm -131.37 140.58 48.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.472 . . . . 10.0 112.196 -177.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.1 120.07 57.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 177.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.7 mt -89.3 -80.27 0.3 Allowed 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.68 -0.408 . . . . 10.0 111.837 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 m -179.04 -166.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.679 . . . . 10.0 109.168 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.6 mp0 -112.91 144.04 43.16 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.273 0.358 . . . . 10.0 110.366 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -81.57 -173.78 4.6 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -21.74 66.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.674 0.749 . . . . 10.0 110.438 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -87.71 -5.61 58.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.059 -0.973 . . . . 10.0 110.534 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.11 4.26 74.86 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.692 -0.765 . . . . 10.0 111.303 -178.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.501 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -63.14 105.15 0.66 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.817 0.341 . . . . 10.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 43' ' ' THR . 8.1 tpp85 -83.71 100.13 10.69 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.446 178.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HG2' HG22 ' A' ' 43' ' ' THR . 88.8 mttt -82.94 114.95 21.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.112 0.482 . . . . 10.0 110.998 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -131.85 147.89 52.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.517 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.674 HD13 ' HB ' ' A' ' 41' ' ' ILE . 33.9 tp -118.19 109.5 16.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -133.25 161.76 33.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.026 0.441 . . . . 10.0 111.283 -178.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -96.27 113.96 25.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.153 -1.055 . . . . 10.0 108.153 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.461 HG12 ' HA ' ' A' ' 9' ' ' ILE . 16.8 m -129.75 158.53 42.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.698 0.285 . . . . 10.0 111.035 -178.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -95.92 124.85 40.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.001 0.429 . . . . 10.0 110.507 179.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -64.52 112.46 3.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.912 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.44 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 57.16 30.85 19.02 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.75 0.656 . . . . 10.0 110.579 -178.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.2 t70 63.02 30.22 16.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 114.708 -1.133 . . . . 10.0 111.096 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.17 -83.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.03 -0.419 . . . . 10.0 111.347 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -96.7 125.12 48.05 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.683 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.516 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.1 Cg_endo -77.93 132.7 11.93 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.726 2.284 . . . . 10.0 111.489 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -151.27 169.12 22.71 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -94.38 123.9 38.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.631 0.253 . . . . 10.0 110.406 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -137.27 129.96 30.16 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.674 ' HB ' HD13 ' A' ' 27' ' ' LEU . 8.8 tt -107.6 123.02 62.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.199 0.523 . . . . 10.0 109.896 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.1 mtt85 -145.23 179.44 7.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.343 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.558 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -124.3 145.55 49.33 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.953 179.426 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.438 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 44.5 m95 -117.52 170.85 8.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.07 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -69.98 158.22 87.84 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.76 -34.95 92.53 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.605 2.204 . . . . 10.0 112.541 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -91.21 -0.52 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.596 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.2 30.17 19.14 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.786 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -84.46 -33.76 23.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.949 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -136.42 174.68 10.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.537 0.685 . . . . 10.0 111.819 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.438 ' HB3' ' CE3' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -141.27 173.25 11.66 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.702 -177.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.58 -157.36 7.25 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.605 -0.807 . . . . 10.0 112.412 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mttm -96.14 151.01 19.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.496 -0.414 . . . . 10.0 111.934 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.26 -121.16 1.25 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.5 tt -152.75 141.79 14.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.407 0.603 . . . . 10.0 111.229 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.9 140.82 38.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.707 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.8 mt -121.15 135.22 55.2 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.398 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 m -76.46 164.31 26.1 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.907 -0.405 . . . . 10.0 109.907 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -58.97 -46.98 86.75 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.98 -44.75 94.29 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.136 0.493 . . . . 10.0 110.315 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.445 ' HB3' HD13 ' B' ' 16' ' ' LEU . 80.4 mt-10 -61.4 -52.05 66.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.746 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.693 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.0 t80 -56.77 -44.29 81.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.311 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.3 -47.73 89.64 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.344 -0.455 . . . . 10.0 112.72 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 92.9 t -68.45 -43.89 83.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.439 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.4 tp -56.35 -49.52 74.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.792 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.693 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.0 mt -64.27 -44.66 91.02 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 121.16 -0.216 . . . . 10.0 111.462 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.2 tttm -54.67 -50.3 68.54 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.477 0.486 . . . . 10.0 110.848 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.548 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 25.2 mm-40 -70.5 -48.76 54.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.425 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 47.8 mt -59.04 -44.2 91.76 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.06 -38.42 95.97 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.411 -0.9 . . . . 10.0 110.996 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -70.09 -25.25 63.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.35 -0.425 . . . . 10.0 110.941 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 29.5 mmmt -67.97 -28.84 67.79 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.039 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 28.7 mt -88.12 -7.8 56.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.876 0.37 . . . . 10.0 110.814 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.523 -0.751 . . . . 10.0 110.172 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 120.767 0.317 . . . . 10.0 110.5 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.48 155.93 19.52 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -60.69 -49.2 78.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 10.0 110.47 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -136.29 101.8 4.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 26.2 tp -77.74 139.45 39.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.7 tppt? -75.29 136.43 40.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.111 0.481 . . . . 10.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -160.47 171.73 18.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.31 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.414 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 10.5 tp10 -153.27 130.34 11.09 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.39 116.97 24.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.114 0.483 . . . . 10.0 110.805 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -88.32 -44.54 15.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.554 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -166.94 130.41 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.98 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.83 141.14 40.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 56.4 mt -113.16 -73.64 0.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.492 -0.483 . . . . 10.0 112.056 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.532 HD12 ' CB ' ' A' ' 68' ' ' GLU . 17.0 mm -128.84 139.43 51.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.1 0.476 . . . . 10.0 112.032 -177.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.8 p -124.44 120.69 59.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 61' ' ' GLU . 29.0 mt -91.11 -81.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.875 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -179.16 -166.35 0.09 Allowed 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.506 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -113.03 140.23 48.01 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.882 0.372 . . . . 10.0 110.829 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . 0.404 ' OD1' ' HE3' ' B' ' 25' ' ' LYS . 11.9 m120 -77.31 -174.63 3.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.177 178.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.18 -18.79 65.57 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.381 0.61 . . . . 10.0 110.599 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -90.37 -5.72 55.85 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.424 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.58 69.2 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 111.247 -0.741 . . . . 10.0 111.247 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.506 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -64.48 104.92 0.85 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.68 0.276 . . . . 10.0 111.373 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.544 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.7 tpp85 -83.12 101.34 11.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.448 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.559 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.4 mttt -84.29 116.81 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.2 0.524 . . . . 10.0 111.073 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -134.12 146.73 50.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.364 -0.835 . . . . 10.0 110.659 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.719 HD13 ' HB ' ' B' ' 41' ' ' ILE . 39.1 tp -116.63 111.25 19.6 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.2 159.27 42.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.086 0.469 . . . . 10.0 111.296 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -93.38 114.25 26.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 m -130.42 157.82 42.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.921 0.391 . . . . 10.0 111.036 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.515 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 0.1 OUTLIER -95.23 124.59 39.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.585 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -64.17 110.91 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.01 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.0 m-80 58.84 30.03 19.56 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 123.859 0.724 . . . . 10.0 110.473 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.8 t70 64.84 28.02 12.84 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.676 -1.147 . . . . 10.0 111.034 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.15 -83.28 0.59 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.018 -0.426 . . . . 10.0 111.746 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -96.03 122.48 58.14 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.658 -0.246 . . . . 10.0 111.509 -178.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.515 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.69 129.55 10.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.976 2.451 . . . . 10.0 111.866 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -148.13 169.79 19.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -94.99 122.53 37.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.404 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.409 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -136.48 131.79 34.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.719 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.4 tt -108.92 122.44 63.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.207 0.527 . . . . 10.0 110.02 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.409 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.3 mtt85 -144.89 -179.71 6.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.44 -177.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.559 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -125.25 145.91 49.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.066 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 45.9 m95 -117.84 171.25 8.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.182 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.3 m -70.34 157.93 88.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.9 -0.407 . . . . 10.0 109.9 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -56.07 -32.05 85.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.601 2.201 . . . . 10.0 112.728 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.94 -3.55 51.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.099 0.476 . . . . 10.0 110.263 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 31.82 12.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.973 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -86.34 -30.86 21.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.032 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -137.91 174.41 10.6 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.401 0.62 . . . . 10.0 111.893 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.38 173.07 11.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.883 -1.053 . . . . 10.0 110.324 -177.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.18 -157.24 7.39 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.226 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.42 147.13 26.7 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.033 -0.686 . . . . 10.0 111.967 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.98 -119.48 1.64 Allowed Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 110.724 -0.95 . . . . 10.0 110.724 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.5 tt -152.84 143.23 15.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 117.308 0.554 . . . . 10.0 111.005 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.46 140.46 38.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.85 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 48.2 mt -121.27 135.0 55.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.497 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.42 164.44 25.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.15 -0.477 . . . . 10.0 109.866 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -60.32 -44.86 95.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.43 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.479 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.1 pt-20 -63.35 -41.52 98.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.117 0.484 . . . . 10.0 110.637 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -64.07 -50.54 67.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.246 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.477 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -59.22 -41.41 88.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.406 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.23 -50.89 62.99 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.088 -0.577 . . . . 10.0 112.334 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 60' ' ' GLU . 47.6 t -66.12 -45.83 89.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.058 0.456 . . . . 10.0 110.413 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.5 tp -55.3 -49.72 71.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.629 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 76.9 mt -61.77 -47.47 85.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.943 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -54.4 -52.4 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.588 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.649 ' HB3' HD12 ' A' ' 14' ' ' ILE . 7.5 mm-40 -68.82 -50.08 53.11 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.551 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.634 ' HB3' HD22 ' A' ' 66' ' ' LEU . 46.9 mt -60.09 -44.45 94.78 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.674 0.25 . . . . 10.0 111.674 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.07 -35.76 91.93 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.306 -0.718 . . . . 10.0 111.306 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -75.04 -25.19 58.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.87 0.367 . . . . 10.0 110.756 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 23.5 mmmt -64.9 -30.82 71.84 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.179 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.487 HD11 ' CB ' ' A' ' 66' ' ' LEU . 26.7 mt -89.29 0.42 56.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.186 -179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.691 -0.671 . . . . 10.0 109.358 179.158 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 110.035 -0.358 . . . . 10.0 110.035 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.45 165.12 11.99 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.412 ' OD1' ' HG2' ' A' ' 4' ' ' LYS . 13.3 t70 -67.34 -58.71 4.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.156 0.503 . . . . 10.0 110.152 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.412 ' HG2' ' OD1' ' A' ' 3' ' ' ASP . 37.3 mmtm -132.79 104.67 6.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.757 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.39 141.18 41.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.774 0.321 . . . . 10.0 110.636 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -70.99 130.82 42.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.436 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.7 p90 -157.03 160.84 39.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.767 0.318 . . . . 10.0 110.934 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.474 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.7 tp10 -147.26 126.28 12.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.568 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.459 ' HA ' HG12 ' A' ' 30' ' ' VAL . 62.2 mt -82.69 106.12 13.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.15 0.5 . . . . 10.0 110.237 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.4 mm -76.49 -41.94 35.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.766 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -166.84 126.91 1.53 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.862 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -75.5 143.12 42.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 77.0 mt -110.01 -75.87 0.62 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.352 -0.539 . . . . 10.0 111.794 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.66 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.9 mm -128.49 137.34 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.53 . . . . 10.0 112.006 -177.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.411 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.5 p -119.83 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 177.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.539 HD22 ' HB ' ' B' ' 64' ' ' VAL . 32.0 mt -92.28 -80.92 0.35 Allowed 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.568 -0.453 . . . . 10.0 111.862 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.84 -168.72 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.527 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -110.34 147.76 33.29 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -83.27 -168.83 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.77 -21.45 65.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.548 0.69 . . . . 10.0 110.317 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -91.5 1.06 57.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.95 -1.023 . . . . 10.0 110.718 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.74 4.77 88.68 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.58 -0.819 . . . . 10.0 111.395 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.527 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.24 103.28 0.37 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.89 0.376 . . . . 10.0 110.994 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.533 ' O ' ' HA ' ' A' ' 43' ' ' THR . 11.3 tpp85 -83.8 100.69 11.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.571 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.564 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.0 mttt -83.4 115.12 21.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.066 0.46 . . . . 10.0 110.828 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.411 ' HG2' HG23 ' A' ' 15' ' ' VAL . 79.8 mt-10 -131.4 143.54 50.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.47 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.71 HD13 ' HB ' ' A' ' 41' ' ' ILE . 40.0 tp -112.43 108.29 17.39 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.157 -1.053 . . . . 10.0 108.157 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -131.54 160.64 34.66 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 10.0 111.213 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -97.11 113.73 25.33 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.501 -0.925 . . . . 10.0 108.501 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.459 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.5 m -127.46 157.0 39.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 120.928 0.394 . . . . 10.0 110.767 -179.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -95.95 125.81 40.76 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.176 178.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -64.62 110.21 2.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.959 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 60.66 27.53 17.25 Favored 'General case' 0 C--O 1.235 0.294 0 O-C-N 124.061 0.851 . . . . 10.0 110.624 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.6 t70 68.41 23.63 7.47 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.91 -1.041 . . . . 10.0 110.709 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.99 -84.67 0.54 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.102 -0.373 . . . . 10.0 111.666 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -91.63 123.27 64.05 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.516 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 62.8 Cg_endo -80.79 124.13 4.97 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.766 2.311 . . . . 10.0 111.808 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -143.08 170.03 16.47 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -96.1 126.57 41.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.684 0.278 . . . . 10.0 110.466 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.433 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -140.4 130.06 24.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.71 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.5 tt -106.55 124.32 61.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.354 0.597 . . . . 10.0 110.019 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.433 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.7 mtt85 -144.66 176.75 9.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.214 -177.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.564 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -123.63 142.11 51.36 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.796 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -117.58 170.66 8.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.932 -0.576 . . . . 10.0 109.616 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.11 159.08 73.59 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -57.81 -31.63 92.84 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.237 1.958 . . . . 10.0 111.773 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -91.57 -1.94 57.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.412 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 60.0 31.41 20.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.804 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -83.8 -33.14 25.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.165 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -135.74 174.88 10.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.366 0.603 . . . . 10.0 111.558 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.33 167.72 21.44 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.818 -1.083 . . . . 10.0 110.769 -177.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.11 -162.4 9.73 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.16 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -95.59 151.01 19.71 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.245 -0.562 . . . . 10.0 111.797 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.13 -125.43 1.61 Allowed Glycine 0 C--N 1.331 0.262 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.365 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.0 143.43 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.518 0.659 . . . . 10.0 111.259 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.92 140.06 39.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.572 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.4 mt -119.78 134.22 55.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.27 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.5 m -79.17 169.55 17.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.325 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.44 -49.8 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.707 0.262 . . . . 10.0 111.707 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -60.98 -43.47 98.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.548 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -61.03 -50.77 71.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.586 -0.733 . . . . 10.0 110.441 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.719 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.3 t80 -56.46 -45.84 80.66 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.239 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.89 -51.47 58.4 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.296 -0.478 . . . . 10.0 112.901 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.2 t -64.96 -42.69 95.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 10.0 110.664 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.7 tp -57.62 -51.83 67.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.807 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.719 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -62.84 -45.47 92.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.47 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -52.65 -51.37 60.42 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.208 0.528 . . . . 10.0 111.246 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 9.6 mm-40 -71.41 -47.49 55.66 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.809 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.513 ' HB3' HD22 ' B' ' 66' ' ' LEU . 48.4 mt -58.4 -44.46 88.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.574 0.226 . . . . 10.0 111.604 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.9 -40.41 99.24 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.577 -0.82 . . . . 10.0 111.143 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -68.53 -26.54 65.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.326 . . . . 10.0 110.728 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 68.3 mmtt -69.66 -27.04 64.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.022 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.445 HD11 ' HB3' ' B' ' 66' ' ' LEU . 35.7 mt -82.37 -25.46 33.78 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.073 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.618 -0.706 . . . . 10.0 110.465 -179.713 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.331 . . . . 10.0 110.223 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.36 171.33 8.64 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.439 ' OD1' ' HG2' ' B' ' 4' ' ' LYS . 13.1 t70 -74.22 -56.6 4.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.03 0.443 . . . . 10.0 110.059 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.439 ' HG2' ' OD1' ' B' ' 3' ' ' ASP . 41.9 mmtm -134.08 101.65 5.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.76 -0.654 . . . . 10.0 109.372 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 37.1 tp -74.56 137.79 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.151 -0.314 . . . . 10.0 110.151 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -70.33 128.56 36.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.785 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -153.5 163.35 40.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.392 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.463 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 11.5 tp10 -150.16 122.9 8.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.436 ' HA ' HG12 ' B' ' 30' ' ' VAL . 56.8 mt -79.07 109.9 14.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.144 0.497 . . . . 10.0 110.555 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.9 mm -79.13 -41.75 23.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.616 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -166.61 125.47 1.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.49 139.41 42.19 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 50.0 mt -108.46 -73.78 0.68 Allowed 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.385 -0.526 . . . . 10.0 112.294 -177.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.495 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.5 mm -128.01 132.22 68.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -177.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.414 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.8 p -115.77 122.37 69.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 177.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.1 mt -93.51 -80.83 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.754 -0.379 . . . . 10.0 111.84 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.8 m 178.94 -169.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.473 -0.565 . . . . 10.0 109.473 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.27 148.07 30.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.582 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -84.28 -171.92 3.88 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -18.69 65.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.383 0.611 . . . . 10.0 110.699 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -92.61 -3.32 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.606 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.82 4.13 76.03 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.418 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.514 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.2 m0 -62.06 104.01 0.43 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.747 0.308 . . . . 10.0 111.02 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.5 tpp85 -84.45 100.75 11.53 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 179.098 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.629 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.4 mttt -82.25 116.24 21.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.016 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.414 ' HG2' HG23 ' B' ' 15' ' ' VAL . 62.0 mt-10 -132.56 141.3 48.65 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.744 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.689 HD13 ' HB ' ' B' ' 41' ' ' ILE . 40.8 tp -110.79 108.11 17.84 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -131.78 159.14 39.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.936 0.398 . . . . 10.0 111.385 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -94.8 113.58 25.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' B' ' 9' ' ' ILE . 14.7 m -126.88 157.79 37.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.884 0.373 . . . . 10.0 110.773 -179.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.1 p -97.26 125.5 41.86 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.32 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -64.53 110.4 2.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.932 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 59.24 30.09 19.77 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.504 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 34.0 t70 66.48 20.85 10.87 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.512 -1.222 . . . . 10.0 111.142 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -87.4 0.45 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.803 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -89.87 122.4 67.96 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-O 120.658 0.266 . . . . 10.0 111.64 -178.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 59.5 Cg_endo -79.47 125.24 6.18 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.86 2.374 . . . . 10.0 111.954 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.423 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 20.1 ttmm -144.12 169.88 17.01 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . 0.423 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 3.2 m-85 -97.24 125.45 41.81 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.441 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.77 129.32 24.33 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.689 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.4 tt -105.12 124.08 59.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.249 0.547 . . . . 10.0 110.044 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.441 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.7 mtt85 -144.29 175.62 9.95 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.346 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.629 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -122.21 142.0 50.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.048 179.698 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -117.73 169.75 9.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.452 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 158.83 73.67 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -56.08 -34.55 93.02 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.153 1.902 . . . . 10.0 111.602 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -88.38 -4.19 58.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.555 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.72 34.93 19.81 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.349 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.68 -34.82 21.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.723 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -134.04 174.34 10.59 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.268 0.556 . . . . 10.0 111.568 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.89 167.79 21.02 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.607 -1.179 . . . . 10.0 110.4 -178.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.0 -161.46 9.42 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.955 -0.64 . . . . 10.0 112.387 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -96.75 148.28 23.05 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.432 -0.452 . . . . 10.0 111.57 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.86 -124.5 1.81 Allowed Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 111.323 -0.711 . . . . 10.0 111.323 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -148.21 142.23 19.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 117.499 0.65 . . . . 10.0 111.129 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.4 HG22 ' HD2' ' B' ' 38' ' ' LYS . 0.7 OUTLIER -103.88 139.01 39.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.918 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 133.16 56.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.477 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.7 m -78.26 170.6 16.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.25 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.32 -52.58 64.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.294 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.579 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.9 pt-20 -58.97 -42.36 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.098 0.475 . . . . 10.0 110.641 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -62.4 -50.19 72.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.667 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.544 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.2 t80 -57.65 -43.19 84.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.586 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.69 -51.77 56.58 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.36 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.579 HG23 ' O ' ' B' ' 60' ' ' GLU . 35.5 t -62.57 -45.84 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 10.0 110.422 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.6 tp -56.43 -53.29 59.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.373 -0.83 . . . . 10.0 110.721 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 32.4 mt -59.9 -48.8 80.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.249 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -52.2 -53.65 40.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.757 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.66 ' HB3' HD12 ' A' ' 14' ' ' ILE . 8.9 mm-40 -69.92 -48.53 58.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.973 -178.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.61 ' HB3' HD22 ' A' ' 66' ' ' LEU . 47.6 mt -59.12 -42.95 91.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.551 0.215 . . . . 10.0 111.418 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.12 -38.97 97.01 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.599 -0.81 . . . . 10.0 111.294 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . 0.448 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.9 t-20 -71.05 -27.46 63.66 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 10.0 110.915 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.0 mmtt -66.99 -26.03 66.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.367 -0.379 . . . . 10.0 111.553 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.525 HD11 ' CB ' ' A' ' 66' ' ' LEU . 23.1 mt -89.62 -13.6 36.75 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.546 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . 0.448 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 42.9 mt-10 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.632 -0.699 . . . . 10.0 110.3 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.7 mmm . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 120.916 0.389 . . . . 10.0 110.304 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.47 179.91 4.13 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.061 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -82.8 -60.73 2.08 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -131.13 94.64 3.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.068 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.16 139.46 50.22 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.801 0.334 . . . . 10.0 110.272 179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -71.75 137.46 47.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.957 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.6 p90 -161.44 172.15 16.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.934 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -155.44 138.13 15.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.436 ' HA ' HG12 ' A' ' 30' ' ' VAL . 54.8 mt -85.47 113.64 24.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.923 0.392 . . . . 10.0 110.335 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.07 -44.05 17.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.964 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -167.78 128.59 1.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.331 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -79.62 136.5 36.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.498 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 58.3 mt -106.99 -75.08 0.64 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.386 0.514 . . . . 10.0 112.386 -178.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.765 HD12 ' HB3' ' B' ' 68' ' ' GLU . 31.8 mm -127.07 140.93 47.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 112.596 0.591 . . . . 10.0 112.596 -177.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.454 HG23 ' HG2' ' A' ' 26' ' ' GLU . 5.1 p -121.2 123.22 69.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 177.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.416 HD22 ' HB ' ' B' ' 64' ' ' VAL . 31.1 mt -92.25 -81.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.542 -0.463 . . . . 10.0 111.572 -178.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -179.98 -174.8 0.28 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 122.748 0.419 . . . . 10.0 110.006 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.586 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 26.5 mp0 -111.12 156.81 20.81 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -102.99 -169.94 1.72 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.003 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.9 -23.43 67.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.391 0.615 . . . . 10.0 110.515 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -87.82 -4.66 58.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.511 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.03 3.56 87.61 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.759 -0.655 . . . . 10.0 112.063 -178.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.586 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 42.0 m0 -55.24 102.54 0.07 Allowed 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.373 0.269 . . . . 10.0 111.649 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.557 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.4 tpp85 -80.22 100.3 8.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.417 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 81.0 mttt -82.35 113.2 19.97 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.89 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.454 ' HG2' HG23 ' A' ' 15' ' ' VAL . 53.0 mt-10 -139.26 153.9 47.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.35 0.595 . . . . 10.0 111.743 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.741 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.5 tp -123.07 107.67 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.933 -1.03 . . . . 10.0 108.26 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -133.94 166.11 23.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.927 0.394 . . . . 10.0 110.88 -177.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.4 ttp180 -105.58 114.9 29.35 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.184 -0.673 . . . . 10.0 109.184 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.8 m -126.15 162.12 30.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.498 -179.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.427 ' HA ' ' O ' ' A' ' 36' ' ' GLU . 1.0 OUTLIER -99.29 123.12 43.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.948 0.404 . . . . 10.0 110.515 179.136 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 14.7 m0 -64.73 112.86 3.42 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.837 -0.619 . . . . 10.0 109.619 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 59.7 26.1 15.16 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.806 0.692 . . . . 10.0 110.207 -178.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t0 63.52 28.48 15.29 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.614 -1.176 . . . . 10.0 110.96 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.69 -74.66 0.61 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.068 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' A' ' 31' ' ' SER . 45.7 tt0 -91.01 118.09 68.34 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.526 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -82.58 120.79 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.601 2.201 . . . . 10.0 110.667 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -150.06 163.07 39.11 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.796 -0.362 . . . . 10.0 110.771 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -83.47 139.48 32.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.538 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -151.05 130.61 13.01 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.741 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -108.83 123.7 64.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.238 0.542 . . . . 10.0 110.111 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -149.1 174.4 12.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.222 -178.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.557 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 2.9 p -123.25 135.52 54.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 49.1 m0 -116.8 176.62 5.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.592 0.234 . . . . 10.0 110.693 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -66.86 153.64 93.71 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.406 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.41 -37.97 77.68 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.387 2.058 . . . . 10.0 111.561 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -83.76 -4.08 58.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.221 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 62.35 24.93 14.87 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.468 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -76.52 -31.73 57.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.973 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -140.07 174.13 10.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.33 0.586 . . . . 10.0 111.475 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.31 171.22 14.75 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.432 -178.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.15 -170.0 11.75 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.497 -0.859 . . . . 10.0 112.285 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -98.38 145.38 26.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.461 -0.435 . . . . 10.0 111.894 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.83 -111.87 0.85 Allowed Glycine 0 N--CA 1.453 -0.2 0 N-CA-C 110.952 -0.859 . . . . 10.0 110.952 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 tt -155.93 141.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 117.306 0.553 . . . . 10.0 110.803 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.2 m -98.44 141.67 31.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.139 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.3 mt -119.62 122.47 41.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.098 0.475 . . . . 10.0 110.543 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -80.93 168.34 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.578 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.13 -38.37 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.577 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.485 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -59.41 -47.84 83.92 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.388 178.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.485 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 29.5 mt-10 -66.96 -56.7 9.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.975 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.734 ' CE2' HD11 ' A' ' 66' ' ' LEU . 9.5 t80 -50.35 -45.84 55.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.437 -0.801 . . . . 10.0 111.956 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.1 -56.48 25.02 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.195 -0.526 . . . . 10.0 113.126 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.17 -43.53 91.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 10.0 111.14 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.0 tp -55.58 -51.61 66.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.973 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.751 HD22 ' HB3' ' B' ' 69' ' ' LEU . 20.5 mt -62.83 -45.47 92.45 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 121.002 -0.279 . . . . 10.0 111.121 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 ttpp -53.82 -52.63 59.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.89 -0.595 . . . . 10.0 111.005 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 15.8 mm-40 -69.69 -49.11 56.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.905 -178.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.9 mt -58.32 -44.78 88.81 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.624 0.25 . . . . 10.0 111.404 -179.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.24 -35.66 92.25 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.405 -0.902 . . . . 10.0 111.348 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -74.57 -18.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.867 0.365 . . . . 10.0 110.81 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 66.2 mmtt -75.19 -26.2 58.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.057 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' B' ' 66' ' ' LEU . 28.1 mt -90.1 -3.31 57.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.938 0.399 . . . . 10.0 110.565 179.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 118.481 -0.771 . . . . 10.0 110.336 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 90.3 mmm . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 120.878 0.37 . . . . 10.0 110.424 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.54 178.43 4.56 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.451 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -82.06 -58.25 3.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -131.79 94.04 3.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.226 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 27.4 tp -70.63 139.08 51.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.253 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -73.02 134.96 44.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 10.0 110.893 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -158.78 170.52 21.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.882 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.494 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.5 tp10 -153.08 134.35 14.22 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.41 ' HA ' HG12 ' B' ' 30' ' ' VAL . 52.2 mt -82.73 110.48 17.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.966 0.412 . . . . 10.0 110.413 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.4 mm -79.8 -48.61 20.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.635 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -164.96 129.46 2.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.229 -179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.93 144.51 36.78 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 57.8 mt -115.08 -70.75 0.78 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.231 -0.588 . . . . 10.0 112.433 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.551 HD12 ' HB3' ' A' ' 68' ' ' GLU . 15.3 mm -128.45 142.54 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.926 0.393 . . . . 10.0 111.847 -176.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.51 118.54 52.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.6 mt -88.23 -80.94 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -177.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 178.46 -172.24 0.13 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.596 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 24.0 mp0 -115.15 151.78 33.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.312 -0.403 . . . . 10.0 109.999 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . 0.401 ' HA ' HD22 ' B' ' 19' ' ' ASN . 3.3 m120 -96.82 -167.88 1.62 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -15.17 63.44 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.345 0.593 . . . . 10.0 110.601 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -94.41 -2.01 52.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.957 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.31 4.31 90.23 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.275 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.596 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.6 m0 -56.94 102.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.5 tpp85 -80.15 100.6 8.33 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.408 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 78.7 mttt -82.25 113.76 20.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.898 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -139.83 155.1 47.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.438 0.637 . . . . 10.0 111.747 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.717 HD13 ' HB ' ' B' ' 41' ' ' ILE . 37.3 tp -124.24 107.91 11.7 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.191 -1.04 . . . . 10.0 108.191 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -133.9 164.42 27.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.918 0.39 . . . . 10.0 110.927 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.1 ttp180 -104.13 114.3 28.44 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.4 m -125.25 162.1 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.748 -179.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.494 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -99.79 121.81 41.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.505 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 17.1 m0 -64.2 112.88 3.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.763 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 59.75 26.18 15.28 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.014 -178.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.0 t0 61.3 33.4 19.0 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 114.517 -1.22 . . . . 10.0 110.491 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.92 -70.05 0.81 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.064 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' B' ' 31' ' ' SER . 44.2 tt0 -94.92 117.58 66.83 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.601 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -81.64 120.16 3.47 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.372 2.048 . . . . 10.0 110.708 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 11.0 ttpt -150.24 163.23 38.81 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.804 -0.358 . . . . 10.0 110.708 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.88 138.51 32.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.347 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -150.04 130.5 13.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.717 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.2 tt -108.53 123.13 64.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.388 0.613 . . . . 10.0 110.14 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -149.03 175.47 11.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.574 -178.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.553 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 4.5 p -124.31 135.4 53.33 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -117.02 175.1 5.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.424 -0.213 . . . . 10.0 110.424 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.7 m -65.49 153.85 89.32 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.452 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.08 -34.97 89.07 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.424 2.083 . . . . 10.0 111.319 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.57 -4.75 59.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.049 -0.978 . . . . 10.0 110.23 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 61.98 23.81 14.08 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.783 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -76.7 -29.7 56.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -141.48 174.53 10.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.557 0.694 . . . . 10.0 111.953 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.15 171.8 13.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.32 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.72 -170.64 12.01 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.238 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.9 mttp -97.57 141.61 30.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.256 0.55 . . . . 10.0 112.426 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -138.57 -119.32 1.72 Allowed Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.386 -1.086 . . . . 10.0 110.386 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -149.43 143.14 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 117.27 0.535 . . . . 10.0 110.674 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 4.0 m -97.81 139.57 33.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.524 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -117.75 119.29 34.46 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.967 0.413 . . . . 10.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.7 166.93 21.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.314 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.0 -35.17 74.46 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.874 0.368 . . . . 10.0 110.922 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.452 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.9 pt-20 -61.75 -46.07 91.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.062 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.452 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 31.3 mt-10 -68.34 -57.21 6.27 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.863 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.5 t80 -52.15 -42.28 63.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.463 -0.789 . . . . 10.0 111.478 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.99 -55.52 30.43 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.875 -0.678 . . . . 10.0 112.954 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.416 ' HB ' HD22 ' A' ' 16' ' ' LEU . 19.1 t -68.66 -42.36 83.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.937 0.399 . . . . 10.0 110.865 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.0 tp -56.59 -50.93 70.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.021 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 60.1 mt -60.62 -50.69 72.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.726 0.298 . . . . 10.0 110.606 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 24.8 tttm -50.84 -53.04 35.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.8 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.765 ' HB3' HD12 ' A' ' 14' ' ' ILE . 30.6 mm-40 -69.4 -52.45 26.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.282 -178.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.751 ' HB3' HD22 ' A' ' 66' ' ' LEU . 62.4 mt -58.87 -43.13 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.91 -38.23 96.22 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.47 -0.872 . . . . 10.0 111.142 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . 0.408 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.4 t-20 -73.51 -20.06 60.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.504 -0.348 . . . . 10.0 111.359 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.8 mmtt -72.64 -27.51 62.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.658 0.266 . . . . 10.0 110.95 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.88 0.46 57.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.984 0.421 . . . . 10.0 111.019 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . 0.408 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.9 mt-10 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.789 -0.624 . . . . 10.0 109.892 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.756 0.312 . . . . 10.0 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.46 160.23 17.98 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -66.96 -53.4 32.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.236 -0.653 . . . . 10.0 109.236 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -139.98 95.23 2.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.195 -0.911 . . . . 10.0 109.697 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.5 tp -64.22 145.77 55.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.852 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.1 tppt? -79.25 136.48 37.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.47 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -164.32 163.53 22.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.189 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.458 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.8 tp10 -145.4 126.09 14.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.533 ' HA ' HG12 ' A' ' 30' ' ' VAL . 84.6 mt -73.83 110.77 8.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.002 0.429 . . . . 10.0 110.147 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mm -80.68 -48.89 19.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -162.96 126.65 2.88 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.042 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -78.39 144.31 36.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 68.7 mt -112.44 -75.46 0.61 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.565 -0.454 . . . . 10.0 111.625 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.566 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.0 mm -128.87 140.35 49.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.304 0.573 . . . . 10.0 112.49 -177.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.452 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.4 p -123.59 120.45 60.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 107.85 -1.167 . . . . 10.0 107.85 177.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.601 HD22 ' HB ' ' B' ' 64' ' ' VAL . 32.5 mt -89.72 -81.68 0.28 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.567 -0.453 . . . . 10.0 112.124 -177.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.2 m -174.51 -168.39 0.37 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -107.44 136.57 47.01 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.827 -0.435 . . . . 10.0 109.827 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -74.43 -173.83 1.85 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.793 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.06 68.45 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.614 0.721 . . . . 10.0 110.574 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -88.66 -1.07 57.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.811 -1.086 . . . . 10.0 110.91 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.36 1.62 81.01 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.125 -0.79 . . . . 10.0 111.125 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -59.06 106.05 0.38 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.838 0.351 . . . . 10.0 111.318 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.523 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.4 tpp85 -84.53 99.74 10.93 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.504 178.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.445 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.3 mttt -82.91 118.29 23.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.425 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.452 ' HG2' HG23 ' A' ' 15' ' ' VAL . 62.6 mt-10 -133.56 149.79 51.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.986 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 40.3 tp -117.76 108.11 14.97 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.612 -0.884 . . . . 10.0 108.612 178.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -135.63 160.97 36.85 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.791 0.329 . . . . 10.0 110.451 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 ttp180 -102.19 115.0 29.63 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.533 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.2 m -125.26 161.85 28.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.691 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.458 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.4 p -93.39 124.52 37.44 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -63.66 108.28 1.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.443 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 61.8 m-80 59.28 30.36 20.08 Favored 'General case' 0 CA--C 1.522 -0.108 0 O-C-N 123.869 0.73 . . . . 10.0 109.703 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 44.1 t0 62.91 26.69 15.67 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.365 -1.289 . . . . 10.0 111.09 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.26 -71.2 0.76 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.128 -0.357 . . . . 10.0 111.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -94.16 114.79 64.13 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.853 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 53.5 Cg_endo -78.27 119.9 4.74 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.164 1.909 . . . . 10.0 110.282 177.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.434 ' HE3' HG21 ' A' ' 56' ' ' THR . 20.7 ttpt -150.03 166.23 30.33 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.889 -0.324 . . . . 10.0 110.489 -178.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -87.01 132.16 33.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 10.0 110.867 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.415 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -144.8 132.96 21.57 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.49 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -109.88 121.83 63.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.356 0.598 . . . . 10.0 109.824 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.415 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.74 179.44 7.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.281 -177.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -128.05 146.01 50.81 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.197 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -117.23 178.16 4.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.938 -0.573 . . . . 10.0 109.783 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.404 ' HG ' ' H ' ' A' ' 50' ' ' LYS . 1.3 p -80.36 161.41 64.97 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -57.63 -29.78 86.46 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.368 2.045 . . . . 10.0 112.612 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -100.5 0.16 39.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.135 0.493 . . . . 10.0 110.323 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 59.14 34.19 23.16 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.219 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.14 -37.22 22.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.102 0.477 . . . . 10.0 110.327 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.404 ' H ' ' HG ' ' A' ' 45' ' ' SER . 43.5 mmtm -139.35 174.38 10.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.912 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.422 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -150.55 173.04 14.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.758 -177.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.42 -162.08 9.99 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.779 -0.724 . . . . 10.0 112.212 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -90.08 162.5 15.29 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.361 -0.493 . . . . 10.0 112.243 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -152.78 -121.63 0.89 Allowed Glycine 0 C--N 1.33 0.229 0 CA-C-N 115.248 -0.887 . . . . 10.0 111.277 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.2 tt -153.66 143.17 14.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 117.48 0.64 . . . . 10.0 110.969 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.434 HG21 ' HE3' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -105.01 145.73 30.03 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.955 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -125.94 132.11 52.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.007 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -75.36 161.61 29.12 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -57.12 -46.23 82.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.559 -179.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.49 -46.13 91.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.944 0.402 . . . . 10.0 110.585 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -59.52 -49.59 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.355 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.738 ' CE2' HD11 ' A' ' 66' ' ' LEU . 15.6 t80 -57.07 -43.84 82.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.22 -0.9 . . . . 10.0 111.356 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.43 -56.3 25.99 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.717 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.87 -41.28 88.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.912 0.387 . . . . 10.0 110.373 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.445 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 17.4 tp -58.2 -54.6 45.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.872 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.738 HD11 ' CE2' ' A' ' 62' ' ' PHE . 22.2 mt -62.44 -46.29 89.19 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.757 -0.201 . . . . 10.0 111.465 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 tttm -50.4 -49.98 53.03 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.603 0.564 . . . . 10.0 111.459 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 13.3 mm-40 -72.35 -48.67 40.11 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.414 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.475 ' HB3' HD22 ' B' ' 66' ' ' LEU . 84.1 mt -57.41 -44.98 85.04 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.05 98.75 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.686 -0.769 . . . . 10.0 111.372 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.469 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 13.1 t-20 -68.06 -28.31 67.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.955 0.407 . . . . 10.0 111.057 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.6 mmtt -67.41 -28.9 68.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.087 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.644 HD11 ' HB3' ' B' ' 66' ' ' LEU . 50.5 mt -89.68 -4.86 57.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.682 -0.236 . . . . 10.0 111.126 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 41.1 mt-10 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.42 -0.8 . . . . 10.0 110.722 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.865 0.364 . . . . 10.0 110.406 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.4 161.78 13.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.2 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.01 -51.81 29.3 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -139.98 94.51 2.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.212 -0.904 . . . . 10.0 109.313 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.3 tp -62.35 145.12 54.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.121 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -79.43 134.08 36.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.658 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -163.44 161.71 24.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.449 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -142.38 130.22 21.7 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.45 ' HA ' HG12 ' B' ' 30' ' ' VAL . 65.5 mt -78.26 105.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.939 0.4 . . . . 10.0 110.802 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 40.8 mm -75.99 -47.42 32.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.619 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -164.04 127.33 2.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.08 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -79.67 141.72 36.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.5 mt -112.09 -72.98 0.69 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.381 -0.528 . . . . 10.0 112.354 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.501 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.6 mm -127.81 140.39 49.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.107 0.48 . . . . 10.0 112.074 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -125.26 115.47 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -84.94 -82.19 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.207 0.447 . . . . 10.0 112.207 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.0 m -177.42 -167.9 0.17 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -107.03 138.25 43.55 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -76.93 -172.67 2.4 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.868 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.87 -13.92 62.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.41 0.624 . . . . 10.0 111.417 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -101.14 2.27 40.02 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.885 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 2.22 85.2 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.269 -178.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 41.1 m0 -59.93 106.06 0.46 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.975 0.417 . . . . 10.0 111.484 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.511 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.1 tpp85 -84.57 100.03 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.646 178.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -82.53 118.73 23.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.908 0.385 . . . . 10.0 110.486 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -133.54 148.32 51.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.93 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.553 HD13 ' HB ' ' B' ' 41' ' ' ILE . 41.4 tp -118.03 107.74 14.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.412 -0.959 . . . . 10.0 108.412 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -135.99 162.5 32.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.893 0.377 . . . . 10.0 110.743 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -103.2 114.83 29.44 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.4 m -123.85 162.2 25.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.46 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.1 p -93.91 123.41 37.25 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.865 -0.421 . . . . 10.0 109.865 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.21 108.01 1.18 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.7 m-80 60.05 29.26 18.84 Favored 'General case' 0 CA--C 1.523 -0.082 0 O-C-N 123.707 0.629 . . . . 10.0 109.773 -177.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t0 61.27 34.57 18.56 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.7 -1.136 . . . . 10.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.09 -71.61 0.72 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.083 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -91.77 114.58 62.41 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.385 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.411 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 39.3 Cg_endo -80.64 118.7 3.54 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.773 1.649 . . . . 10.0 109.964 178.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -148.23 166.62 27.39 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 110.217 -0.29 . . . . 10.0 110.217 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -87.56 132.79 33.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.583 -0.281 . . . . 10.0 110.666 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -145.57 132.07 19.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.99 -0.744 . . . . 10.0 108.99 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.553 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.3 tt -108.94 121.65 62.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.442 0.639 . . . . 10.0 109.915 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.423 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.2 mtt85 -144.11 179.88 6.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.307 -178.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -128.86 146.3 50.97 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.402 -179.762 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -117.56 176.66 5.07 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.941 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -77.64 161.15 72.94 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.211 -0.662 . . . . 10.0 109.211 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.41 -30.25 87.31 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.268 1.979 . . . . 10.0 112.16 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -97.14 -4.98 38.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.74 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 64.01 29.83 14.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.558 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -82.35 -37.31 25.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.111 0.481 . . . . 10.0 110.293 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -137.54 171.77 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.984 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . 0.405 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -148.82 173.13 13.6 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.577 -178.068 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.86 -158.45 8.84 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.849 -0.691 . . . . 10.0 112.271 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -92.64 160.63 14.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.16 0.505 . . . . 10.0 112.307 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.405 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -152.31 -127.95 1.33 Allowed Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.654 -0.979 . . . . 10.0 110.654 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.5 tt -147.98 143.32 19.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 117.511 0.656 . . . . 10.0 111.24 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -103.67 145.02 30.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.685 -0.688 . . . . 10.0 111.132 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 81.5 mt -125.8 131.63 52.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.266 -0.424 . . . . 10.0 109.99 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -75.29 161.33 29.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.17 -47.0 82.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.702 0.287 . . . . 10.0 111.657 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.477 ' O ' HG23 ' B' ' 64' ' ' VAL . 12.1 pt-20 -62.17 -42.16 99.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.987 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -63.12 -48.72 77.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.868 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.528 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -59.29 -40.19 85.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.756 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.28 -56.06 27.3 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.176 -0.535 . . . . 10.0 112.625 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.601 ' HB ' HD22 ' A' ' 16' ' ' LEU . 8.1 t -62.16 -41.69 92.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.001 0.429 . . . . 10.0 110.486 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.3 tp -58.03 -54.48 46.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.048 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.644 ' HB3' HD11 ' A' ' 73' ' ' LEU . 51.1 mt -61.31 -48.45 81.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.577 -0.283 . . . . 10.0 111.219 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -49.57 -52.71 28.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.844 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 8.0 mm-40 -71.31 -48.22 51.9 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.958 -178.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.592 ' HB3' HD22 ' A' ' 66' ' ' LEU . 60.5 mt -58.57 -45.24 89.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.71 -0.223 . . . . 10.0 111.56 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.64 96.24 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.685 -0.769 . . . . 10.0 111.358 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . 0.553 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.6 t-20 -70.9 -26.61 63.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.931 0.396 . . . . 10.0 111.149 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.3 mmtt -68.28 -27.21 66.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.272 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.592 HD11 ' CB ' ' A' ' 66' ' ' LEU . 22.5 mt -90.9 -2.35 57.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.974 -0.29 . . . . 10.0 111.446 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . 0.553 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.4 mt-10 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.606 -0.711 . . . . 10.0 110.038 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.894 0.378 . . . . 10.0 110.572 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.78 161.83 16.47 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.85 -58.74 5.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.986 0.422 . . . . 10.0 110.291 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.12 93.48 3.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.004 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.78 141.16 58.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -74.25 132.39 42.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -156.77 166.19 34.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.958 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.435 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.7 tp10 -154.56 129.39 9.39 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -78.11 114.68 19.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.106 0.479 . . . . 10.0 110.147 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.7 mm -85.28 -41.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.171 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -169.42 127.73 0.97 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.685 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -75.28 143.94 42.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 85.2 mt -114.78 -73.7 0.64 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.349 -0.541 . . . . 10.0 111.626 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.671 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.7 mm -129.19 143.85 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 10.0 112.315 -177.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.428 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.7 p -128.24 123.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 108.205 -1.035 . . . . 10.0 108.205 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.588 HD22 ' HB ' ' B' ' 64' ' ' VAL . 35.4 mt -91.49 -81.37 0.33 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.263 -0.575 . . . . 10.0 111.5 -178.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -177.27 -171.87 0.36 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -104.1 133.46 49.01 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -73.5 -173.72 1.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.684 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.86 -30.63 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.72 0.771 . . . . 10.0 110.31 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -83.64 -2.14 55.48 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.544 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.02 2.28 81.08 Favored Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.406 -0.902 . . . . 10.0 110.947 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 40.9 m0 -60.03 105.57 0.41 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.981 0.42 . . . . 10.0 111.191 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.3 tpp85 -82.77 100.11 10.08 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.492 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.573 ' HG2' HG22 ' A' ' 43' ' ' THR . 86.9 mttt -80.92 115.09 20.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.435 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.428 ' HG2' HG23 ' A' ' 15' ' ' VAL . 60.9 mt-10 -133.09 154.25 50.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.998 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' HB ' ' A' ' 41' ' ' ILE . 36.1 tp -125.42 107.96 11.18 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -134.9 156.72 48.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.804 0.335 . . . . 10.0 110.899 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 29' ' ' ARG . 37.6 ttm180 -90.76 114.72 27.16 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.03 -0.73 . . . . 10.0 109.03 178.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.7 m -126.03 156.54 36.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.805 0.336 . . . . 10.0 110.763 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.8 p -94.45 122.94 37.54 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.933 0.397 . . . . 10.0 110.565 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -64.42 109.47 1.95 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.049 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.0 m-80 60.33 31.04 20.29 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.67 -0.696 . . . . 10.0 110.151 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.19 17.05 10.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.548 -1.205 . . . . 10.0 111.222 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.07 -97.79 0.28 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.446 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.78 124.48 85.04 Favored Pre-proline 0 C--O 1.234 0.247 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.9 Cg_endo -80.09 123.78 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.832 2.355 . . . . 10.0 111.456 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -142.27 167.23 22.59 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.738 -0.385 . . . . 10.0 110.169 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -92.36 128.74 38.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.127 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.443 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.7 t70 -141.69 130.45 22.89 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.64 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.4 tt -106.45 122.33 60.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 110.03 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.443 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.7 mtt85 -144.87 -178.35 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.105 -177.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.573 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -127.68 142.4 51.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.817 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -117.47 175.06 5.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 10.0 109.783 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.53 159.67 71.53 Favored Pre-proline 0 C--N 1.32 -0.703 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -59.58 -28.38 87.28 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.347 2.032 . . . . 10.0 111.981 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -93.43 -5.51 49.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.126 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.12 31.61 21.43 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.563 -179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 50' ' ' LYS . 13.5 pt-20 -81.74 -40.0 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.531 -0.759 . . . . 10.0 110.927 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.418 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 44.8 mmtm -140.24 173.64 11.31 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.82 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.421 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -148.38 172.23 14.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.708 -177.755 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -130.51 -154.65 8.05 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.708 -0.758 . . . . 10.0 112.232 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -100.46 155.23 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.253 -0.557 . . . . 10.0 112.221 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.6 -120.27 1.23 Allowed Glycine 0 CA--C 1.518 0.246 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.921 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -150.52 142.66 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 117.564 0.682 . . . . 10.0 111.275 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.28 146.01 29.41 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.771 -0.65 . . . . 10.0 111.011 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.7 mt -131.55 127.18 36.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 m -80.26 171.61 14.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.699 0.285 . . . . 10.0 111.194 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -52.16 -59.43 4.38 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -59.52 -45.58 91.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.622 0.249 . . . . 10.0 111.641 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -59.86 -50.18 74.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 10.0 110.7 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.681 ' CE2' HD11 ' A' ' 66' ' ' LEU . 39.9 t80 -62.18 -41.68 98.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.397 -0.819 . . . . 10.0 111.215 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.77 57.22 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 116.069 -0.514 . . . . 10.0 112.913 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.43 -41.68 93.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.903 0.383 . . . . 10.0 110.226 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.522 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -57.31 -52.27 66.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.45 179.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.681 HD11 ' CE2' ' A' ' 62' ' ' PHE . 18.1 mt -62.38 -45.21 94.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.733 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -51.99 -50.13 61.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.172 -179.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 5.5 mm-40 -72.71 -46.31 54.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.664 -179.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 60.9 mt -58.34 -45.34 88.3 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.8 0.333 . . . . 10.0 111.575 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.38 -39.86 98.24 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 111.166 -0.774 . . . . 10.0 111.166 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 18.0 t-20 -67.22 -29.82 69.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.994 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.4 mmtt -68.12 -27.3 66.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.735 0.302 . . . . 10.0 110.731 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.586 HD11 ' HB3' ' B' ' 66' ' ' LEU . 25.5 mt -89.47 -8.45 52.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.039 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.457 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 33.4 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.62 -0.705 . . . . 10.0 110.029 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 CA-C-O 120.918 0.389 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.49 165.17 11.33 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.757 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -69.06 -58.95 3.41 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -133.42 94.71 3.36 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 28.7 tp -65.93 140.94 58.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.25 179.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -75.28 131.14 40.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.398 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -154.5 168.47 26.61 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.266 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.476 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.6 tp10 -155.86 128.2 7.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.8 mt -78.13 110.83 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.492 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 25.7 mm -80.92 -42.46 20.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.479 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -169.34 126.85 0.94 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.434 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -74.84 144.41 43.46 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 68.0 mt -115.8 -72.85 0.67 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.447 -0.501 . . . . 10.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.565 HD12 ' CB ' ' A' ' 68' ' ' GLU . 22.4 mm -127.86 142.93 42.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.281 0.562 . . . . 10.0 112.144 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.438 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.6 p -126.8 126.38 68.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 107.801 -1.185 . . . . 10.0 107.801 177.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 52.2 mt -93.91 -81.56 0.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.687 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.27 -172.31 0.3 Allowed 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.435 -0.579 . . . . 10.0 109.435 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -104.46 129.35 52.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -70.59 -174.92 0.95 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.998 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.83 -27.9 69.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.356 0.598 . . . . 10.0 110.841 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -88.42 0.7 55.95 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.78 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.36 2.04 83.2 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.117 -0.793 . . . . 10.0 111.117 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -60.0 105.51 0.4 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.001 0.429 . . . . 10.0 111.445 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.502 ' O ' ' HA ' ' B' ' 43' ' ' THR . 11.7 tpp85 -81.7 100.8 9.68 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.769 178.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.587 ' HG2' HG22 ' B' ' 43' ' ' THR . 82.2 mttt -81.08 116.85 21.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.625 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.438 ' HG2' HG23 ' B' ' 15' ' ' VAL . 62.9 mt-10 -135.31 152.87 51.9 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.978 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.688 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.4 tp -125.34 108.05 11.3 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -134.84 156.0 49.67 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.112 -177.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.43 ' HD2' HH11 ' B' ' 29' ' ' ARG . 39.5 ttm180 -89.59 114.57 26.18 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 m -125.78 156.41 35.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.775 0.321 . . . . 10.0 110.455 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.476 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.0 OUTLIER -94.09 124.28 38.01 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.362 179.184 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -65.16 109.66 2.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 10.0 109.934 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 60.93 30.98 19.95 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.151 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 66.36 22.07 10.85 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.801 -1.09 . . . . 10.0 110.778 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.08 -96.86 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.419 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -78.66 122.85 85.35 Favored Pre-proline 0 C--O 1.234 0.24 0 CA-C-O 120.845 0.355 . . . . 10.0 111.854 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.7 Cg_endo -79.66 124.02 5.56 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.913 2.409 . . . . 10.0 111.255 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -143.45 169.03 18.45 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.02 -0.363 . . . . 10.0 110.02 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.29 128.97 41.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.429 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -141.69 129.33 21.53 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.688 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.6 tt -105.23 122.81 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 10.0 110.084 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.429 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -145.04 -178.6 6.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.239 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.587 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -128.09 142.67 51.14 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 109.942 179.561 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -117.6 174.15 6.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.837 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.83 159.55 76.11 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.95 -26.6 82.81 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.332 2.021 . . . . 10.0 111.954 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -95.12 -5.52 43.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.037 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.84 31.35 20.72 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.538 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.444 ' HG3' ' N ' ' B' ' 50' ' ' LYS . 11.5 pt-20 -81.49 -39.76 24.28 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.893 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . 0.444 ' N ' ' HG3' ' B' ' 49' ' ' GLU . 39.1 mmtm -139.43 173.05 11.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.808 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -146.78 172.38 13.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.524 -177.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.17 -154.69 7.94 Favored Glycine 0 C--O 1.228 -0.278 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.34 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . 0.403 ' HA ' ' NH2' ' B' ' 42' ' ' ARG . 42.1 mttp -101.08 150.49 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 122.298 -0.531 . . . . 10.0 112.264 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.51 -123.14 1.88 Allowed Glycine 0 C--N 1.332 0.311 0 N-CA-C 110.595 -1.002 . . . . 10.0 110.595 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -147.93 142.59 19.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 117.653 0.726 . . . . 10.0 111.065 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 140.76 37.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.338 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 52.4 mt -126.2 126.79 44.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.095 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m -78.68 173.86 12.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.831 0.348 . . . . 10.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -57.16 -56.73 18.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.105 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.562 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.7 pt-20 -61.16 -44.17 97.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.651 0.262 . . . . 10.0 111.494 -179.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -62.77 -48.05 80.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.015 0.436 . . . . 10.0 110.749 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -64.64 -38.58 91.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.436 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.84 -53.66 44.42 Favored Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.117 -0.492 . . . . 10.0 112.549 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.588 ' HB ' HD22 ' A' ' 16' ' ' LEU . 20.5 t -61.42 -43.33 96.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 10.0 110.047 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.4 tp -57.26 -52.48 65.15 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.615 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.586 ' HB3' HD11 ' A' ' 73' ' ' LEU . 80.9 mt -59.32 -51.51 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.18 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.1 tttm -48.52 -52.09 24.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.873 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.671 ' HB3' HD12 ' A' ' 14' ' ' ILE . 14.5 mm-40 -71.15 -48.12 53.78 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.951 -178.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.681 ' HB3' HD22 ' A' ' 66' ' ' LEU . 55.9 mt -58.89 -44.55 91.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.98 -41.11 99.64 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.924 -0.87 . . . . 10.0 110.924 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 12.0 t-20 -67.08 -30.0 69.92 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.909 0.385 . . . . 10.0 111.258 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.604 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.7 mmtt -65.13 -31.34 72.48 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.312 -0.242 . . . . 10.0 111.146 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.536 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.5 mt -90.12 -5.85 56.06 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.718 -0.393 . . . . 10.0 111.642 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . 0.457 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 28.1 mt-10 . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.622 -0.704 . . . . 10.0 110.47 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.941 0.4 . . . . 10.0 110.177 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.76 162.53 13.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.9 -53.0 14.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -133.93 94.8 3.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.006 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 21.9 tp -67.73 144.4 55.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.605 178.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -77.58 133.4 38.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.701 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -161.1 172.91 15.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.479 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.6 133.96 11.65 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.42 ' HA ' HG12 ' A' ' 30' ' ' VAL . 65.1 mt -83.8 107.9 15.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 120.985 0.421 . . . . 10.0 110.031 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.2 mm -76.0 -45.85 35.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -165.23 131.18 2.7 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.632 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.21 144.63 34.22 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 83.1 mt -113.7 -74.63 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.279 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.681 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.0 mm -132.1 139.15 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.246 0.546 . . . . 10.0 112.171 -177.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -120.17 122.21 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.851 -1.166 . . . . 10.0 107.851 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.489 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.0 mt -89.03 -80.67 0.29 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.533 -0.467 . . . . 10.0 111.917 -177.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 m 179.2 -169.41 0.1 Allowed 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.414 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 32.9 mp0 -106.45 146.27 30.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.263 179.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -87.86 -170.39 2.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.27 -24.56 67.7 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.532 0.682 . . . . 10.0 110.71 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -93.9 3.28 55.61 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.061 -0.972 . . . . 10.0 110.757 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.75 8.08 86.47 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.8 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.414 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -60.82 103.97 0.31 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.755 0.312 . . . . 10.0 111.5 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.513 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.1 tpp85 -81.58 99.26 8.74 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.469 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.6 mttt -85.37 117.82 24.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.918 0.39 . . . . 10.0 110.612 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG2' HG23 ' A' ' 15' ' ' VAL . 48.6 mt-10 -135.12 153.71 51.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.529 -0.759 . . . . 10.0 111.123 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.544 HD13 ' HB ' ' A' ' 41' ' ' ILE . 34.9 tp -123.16 107.23 11.5 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -135.79 154.96 51.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.315 -178.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -91.24 115.05 27.71 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.5 m -123.85 160.43 27.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.696 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.479 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -97.29 122.83 40.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.349 179.059 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.5 m0 -63.64 110.97 2.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.898 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.457 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 58.36 30.29 19.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.41 0.624 . . . . 10.0 110.18 -178.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.9 t70 62.53 29.64 17.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.802 -1.09 . . . . 10.0 111.028 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.7 -74.98 0.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 O-C-N 122.103 -0.373 . . . . 10.0 111.49 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.51 112.69 50.04 Favored Pre-proline 0 C--N 1.328 -0.357 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.422 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.8 Cg_endo -80.45 120.18 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.392 2.061 . . . . 10.0 110.714 178.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttpt -152.35 172.22 16.8 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.843 -0.343 . . . . 10.0 110.482 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -91.06 134.94 34.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.675 0.274 . . . . 10.0 111.262 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -146.88 130.45 16.85 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.544 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.6 tt -107.14 123.45 62.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.283 0.563 . . . . 10.0 110.194 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.4 ' HG2' ' HA3' ' A' ' 54' ' ' GLY . 3.1 mtt85 -146.32 179.28 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.34 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.513 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -126.82 145.11 50.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.147 179.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -117.4 173.5 6.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.457 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -76.69 156.57 82.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.17 -33.08 95.24 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.396 2.064 . . . . 10.0 112.943 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -97.27 2.85 51.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.811 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 56.99 41.68 27.31 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.266 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.78 -37.21 14.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.622 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -142.21 174.36 10.68 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.019 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.68 172.43 13.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.458 -0.792 . . . . 10.0 111.234 -177.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -134.74 -165.89 10.98 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 121.182 -0.533 . . . . 10.0 111.917 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.6 mttp -94.53 156.16 16.58 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.024 -0.692 . . . . 10.0 111.988 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.4 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.67 -130.76 1.76 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.017 -0.833 . . . . 10.0 111.017 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 tt -144.23 143.72 23.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 117.723 0.761 . . . . 10.0 111.44 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.73 144.2 31.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.966 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -125.01 131.53 53.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.379 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.94 162.92 25.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.553 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.9 -51.7 66.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -178.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.06 -44.68 97.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.777 0.323 . . . . 10.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.452 ' HB3' HD13 ' B' ' 16' ' ' LEU . 79.8 mt-10 -62.19 -45.72 92.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.448 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.685 ' CE2' HD11 ' A' ' 66' ' ' LEU . 29.2 t80 -61.39 -42.61 99.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.019 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.48 -53.76 43.46 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.394 -0.432 . . . . 10.0 112.457 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.5 t -59.97 -41.63 86.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.986 0.422 . . . . 10.0 110.262 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.1 tp -59.97 -53.98 51.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.713 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.685 HD11 ' CE2' ' A' ' 62' ' ' PHE . 17.3 mt -60.89 -46.88 88.88 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.637 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.6 tttm -49.93 -55.28 15.06 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.735 0.647 . . . . 10.0 111.43 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.493 ' CB ' HD12 ' B' ' 14' ' ' ILE . 26.2 mm-40 -68.9 -45.45 70.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.736 -0.666 . . . . 10.0 111.788 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 67.4 mt -59.17 -45.41 91.08 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.898 0.38 . . . . 10.0 111.434 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.78 -36.74 93.77 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.932 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.413 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 6.8 t-20 -74.37 -28.48 61.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.807 0.337 . . . . 10.0 110.919 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.6 mmtt -66.86 -28.43 68.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.898 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.553 HD11 ' HB3' ' B' ' 66' ' ' LEU . 31.4 mt -85.4 -2.38 58.04 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.773 0.286 . . . . 10.0 111.773 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.413 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 46.9 mt-10 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.507 -0.759 . . . . 10.0 110.831 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 120.881 0.372 . . . . 10.0 110.116 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.28 163.17 13.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -75.54 -47.91 24.77 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -136.9 94.0 2.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.832 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.9 tp -67.64 143.05 56.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.592 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.517 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.7 tppt? -78.16 131.7 37.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.649 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -159.49 174.43 14.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.843 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -156.56 133.19 10.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.411 ' HA ' HG12 ' B' ' 30' ' ' VAL . 54.3 mt -83.59 104.17 11.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.16 0.505 . . . . 10.0 110.582 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.5 mm -71.8 -50.29 39.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.504 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -159.99 128.19 4.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.232 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -75.54 145.46 41.25 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 93.6 mt -116.61 -70.94 0.76 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.248 -0.581 . . . . 10.0 111.892 -179.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.493 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.2 mm -133.46 140.4 46.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.09 0.472 . . . . 10.0 111.654 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.88 119.82 57.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 107.589 -1.263 . . . . 10.0 107.589 177.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . 0.452 HD13 ' HB3' ' A' ' 61' ' ' GLU . 35.5 mt -86.51 -81.42 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.453 -0.499 . . . . 10.0 111.971 -177.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.54 -168.5 0.15 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.459 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 30.1 mp0 -108.97 142.06 40.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 178.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -82.57 -169.72 2.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.908 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.84 65.75 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.326 0.584 . . . . 10.0 111.012 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 24.8 mttt -94.35 4.24 54.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.088 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.85 5.86 88.97 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.752 -0.737 . . . . 10.0 111.823 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.459 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -59.36 106.1 0.41 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.726 0.298 . . . . 10.0 111.452 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -83.58 99.76 10.38 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.491 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.5 mttt -84.95 117.71 24.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 110.818 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -134.76 154.05 51.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.949 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.658 HD13 ' HB ' ' B' ' 41' ' ' ILE . 46.7 tp -123.96 107.41 11.31 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 178.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -135.52 152.54 51.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.175 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -88.83 114.47 25.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' B' ' 9' ' ' ILE . 11.3 m -123.07 161.63 24.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.661 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.51 123.94 41.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.89 0.376 . . . . 10.0 110.246 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -64.07 109.4 1.81 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.839 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.7 m-80 59.46 30.23 19.88 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.109 -178.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.6 t70 63.53 29.55 15.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.994 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -122.58 -71.76 0.71 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.491 -0.322 . . . . 10.0 111.786 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -89.18 112.58 52.0 Favored Pre-proline 0 C--N 1.329 -0.316 0 N-CA-C 111.887 0.328 . . . . 10.0 111.887 -178.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -79.8 119.65 4.07 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.017 1.811 . . . . 10.0 110.562 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -151.42 173.5 14.48 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.719 -0.392 . . . . 10.0 110.171 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -93.28 135.52 34.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.57 0.224 . . . . 10.0 111.159 -179.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -147.44 129.81 15.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.658 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.8 tt -105.7 123.29 60.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.247 0.546 . . . . 10.0 110.115 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.413 ' HG2' ' HA3' ' B' ' 54' ' ' GLY . 3.5 mtt85 -146.11 178.75 7.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.418 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.499 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -126.16 145.15 50.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.984 179.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -117.76 174.13 6.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.186 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 156.26 82.38 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 178.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.77 -36.42 98.55 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.433 2.088 . . . . 10.0 112.662 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.34 1.81 56.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.028 0.442 . . . . 10.0 110.697 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.59 44.99 20.03 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.11 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -93.5 -37.55 11.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.622 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -140.25 173.4 11.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.333 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.86 170.74 15.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.985 -1.007 . . . . 10.0 110.819 -178.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.54 -165.95 11.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.127 -0.559 . . . . 10.0 111.762 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.6 151.94 18.91 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.139 -0.624 . . . . 10.0 111.872 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.413 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -146.58 -133.13 2.43 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.176 -0.92 . . . . 10.0 110.83 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -142.22 145.36 23.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 117.498 0.649 . . . . 10.0 111.478 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -103.55 144.92 30.78 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.353 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.51 130.28 51.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.244 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -77.95 163.43 25.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -56.62 -52.73 63.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.542 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.8 pt-20 -58.98 -44.37 91.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 10.0 111.157 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -63.95 -45.37 89.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.706 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.457 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.9 t80 -63.21 -39.69 95.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.328 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.87 -52.39 53.22 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.304 179.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 60' ' ' GLU . 21.5 t -60.87 -43.97 96.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.088 0.471 . . . . 10.0 109.933 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.93 -55.53 33.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.917 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.553 ' HB3' HD11 ' A' ' 73' ' ' LEU . 52.5 mt -57.98 -50.74 72.34 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.354 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -49.38 -55.13 13.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.022 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.681 ' HB3' HD12 ' A' ' 14' ' ' ILE . 36.6 mm-40 -69.05 -45.85 69.33 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.88 -178.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.66 ' HB3' HD22 ' A' ' 66' ' ' LEU . 71.7 mt -60.88 -44.23 97.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.813 0.339 . . . . 10.0 111.648 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.32 -37.53 94.74 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.735 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . 0.485 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.3 t-20 -73.3 -31.47 64.05 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.843 0.354 . . . . 10.0 110.765 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.3 mmtt -64.09 -25.88 68.3 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.55 0.574 . . . . 10.0 112.55 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.653 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.0 mt -90.42 4.94 49.53 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.829 -0.348 . . . . 10.0 111.689 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . 0.485 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.7 mt-10 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.325 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 CA-C-O 120.845 0.355 . . . . 10.0 110.558 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.64 168.53 9.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.194 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -64.74 -58.35 6.49 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -136.75 110.69 8.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.066 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.0 tp -80.38 133.12 35.87 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.431 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.0 tppt? -67.65 133.79 49.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.829 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -158.1 168.03 28.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.42 . . . . 10.0 109.919 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 12.3 tp10 -149.19 125.54 10.86 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.886 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 30' ' ' VAL . 61.4 mt -79.31 106.08 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.55 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.6 mm -72.06 -46.08 60.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.01 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.81 132.57 1.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.651 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -75.93 145.12 40.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.969 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 79.5 mt -112.65 -74.79 0.62 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.662 -0.415 . . . . 10.0 111.635 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.682 HD12 ' HB3' ' B' ' 68' ' ' GLU . 30.6 mm -132.37 137.37 54.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.767 0.655 . . . . 10.0 112.767 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.417 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.0 p -118.85 125.36 74.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.504 HD22 ' HB ' ' B' ' 64' ' ' VAL . 30.1 mt -94.18 -81.32 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 10.0 112.073 -177.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.0 m -172.88 -168.36 0.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.77 -0.456 . . . . 10.0 109.77 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.515 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 2.2 mp0 -112.37 135.06 53.52 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -73.27 -173.67 1.4 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.75 0.31 . . . . 10.0 110.728 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.82 -20.79 66.59 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.611 0.72 . . . . 10.0 109.896 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -91.1 -1.81 57.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.767 -1.106 . . . . 10.0 110.522 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 1.19 85.99 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.987 -0.845 . . . . 10.0 110.987 -178.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.515 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.2 m0 -60.27 108.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.82 0.343 . . . . 10.0 111.606 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' A' ' 43' ' ' THR . 6.8 tpp85 -86.93 99.61 11.99 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.407 178.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.625 ' HG2' HG22 ' A' ' 43' ' ' THR . 86.2 mttt -83.05 118.54 23.6 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.07 0.462 . . . . 10.0 110.587 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.417 ' HG2' HG23 ' A' ' 15' ' ' VAL . 60.1 mt-10 -133.52 145.17 49.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.853 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.716 HD13 ' HB ' ' A' ' 41' ' ' ILE . 40.7 tp -115.38 107.86 15.77 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -133.77 159.1 41.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.933 0.397 . . . . 10.0 110.958 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -94.08 114.09 26.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 9' ' ' ILE . 17.1 m -127.31 158.77 38.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.896 0.379 . . . . 10.0 110.821 -179.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.495 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -98.41 125.53 43.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.958 0.409 . . . . 10.0 110.475 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -64.23 108.95 1.71 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.843 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 61.19 25.66 15.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.027 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.9 t70 66.89 21.81 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.794 -1.093 . . . . 10.0 110.437 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.12 -75.92 0.61 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.281 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -98.89 120.74 57.94 Favored Pre-proline 0 C--N 1.329 -0.292 0 N-CA-C 111.776 0.287 . . . . 10.0 111.776 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.3 Cg_endo -79.45 120.81 4.53 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.861 2.374 . . . . 10.0 111.477 178.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.9 ttmm -143.52 168.49 19.74 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -92.02 129.5 37.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.596 0.236 . . . . 10.0 110.694 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.451 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -141.83 132.46 25.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.716 ' HB ' HD13 ' A' ' 27' ' ' LEU . 8.8 tt -110.78 121.21 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.239 0.542 . . . . 10.0 110.048 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.451 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.8 mtt85 -143.23 -178.74 6.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.446 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.625 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -125.61 143.02 51.21 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.125 179.5 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -117.91 169.31 9.74 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.664 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.18 156.46 87.99 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.62 -27.81 84.04 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.267 1.978 . . . . 10.0 112.048 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -94.75 -0.86 53.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.817 -0.628 . . . . 10.0 110.417 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 58.71 31.37 21.09 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.718 -0.673 . . . . 10.0 111.004 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -82.08 -36.41 27.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.895 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -137.8 175.22 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.359 0.599 . . . . 10.0 111.332 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.1 172.21 13.33 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.86 -1.064 . . . . 10.0 110.558 -178.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.08 -164.9 10.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.971 -0.633 . . . . 10.0 112.157 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -96.31 151.74 19.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.937 -0.743 . . . . 10.0 112.073 -179.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.26 -126.98 1.53 Allowed Glycine 0 C--N 1.332 0.349 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.21 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 tt -142.98 145.06 23.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-N 117.599 0.7 . . . . 10.0 111.453 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -107.7 139.96 41.48 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.886 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 36.7 mt -124.19 132.31 53.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.889 0.376 . . . . 10.0 110.275 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 m -76.56 164.55 25.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.934 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -60.82 -44.04 97.43 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.701 0.259 . . . . 10.0 111.701 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -60.43 -47.29 86.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.197 0.522 . . . . 10.0 110.708 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.573 ' HB3' HD13 ' B' ' 16' ' ' LEU . 38.6 mt-10 -64.03 -45.2 89.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.597 179.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.721 ' CE2' HD11 ' A' ' 66' ' ' LEU . 20.3 t80 -58.25 -44.45 88.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.329 -0.85 . . . . 10.0 111.005 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.54 -52.72 51.45 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.312 -0.47 . . . . 10.0 112.379 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.5 t -61.9 -42.85 96.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 120.969 0.414 . . . . 10.0 110.587 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.548 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.8 tp -57.42 -55.65 32.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.584 -0.735 . . . . 10.0 110.932 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.721 HD11 ' CE2' ' A' ' 62' ' ' PHE . 20.3 mt -63.25 -43.03 99.17 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.007 -0.277 . . . . 10.0 111.614 -179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.3 ttpp -51.56 -51.54 54.52 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.424 0.453 . . . . 10.0 111.189 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.549 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 32.8 mm-40 -71.89 -44.18 64.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.394 -179.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 73.2 mt -58.8 -45.31 90.19 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.26 94.54 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.6 -0.809 . . . . 10.0 111.092 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.25 -29.69 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 10.0 110.591 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 34.3 mmtt -68.67 -25.25 64.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.22 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.572 HD11 ' HB3' ' B' ' 66' ' ' LEU . 37.4 mt -89.55 -0.79 57.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.666 -179.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.138 -0.934 . . . . 10.0 111.019 -179.216 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.03 0.443 . . . . 10.0 110.553 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.98 164.78 11.69 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -62.57 -58.26 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.464 0.649 . . . . 10.0 109.449 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -134.15 112.92 11.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.056 -0.975 . . . . 10.0 109.36 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 32.2 tp -82.33 133.95 35.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.6 tppt? -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.948 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -155.48 163.84 39.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.254 -0.43 . . . . 10.0 109.842 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.488 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.5 tp10 -145.97 126.49 14.14 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.597 -0.52 . . . . 10.0 109.597 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.484 ' HA ' HG12 ' B' ' 30' ' ' VAL . 39.5 mt -79.6 108.78 13.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.453 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -74.86 -45.1 44.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.874 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -170.15 134.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.655 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -76.89 144.56 38.85 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.616 179.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 76.2 mt -113.76 -72.21 0.71 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.449 -0.5 . . . . 10.0 112.08 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.447 HD12 ' CB ' ' A' ' 68' ' ' GLU . 13.2 mm -131.52 139.15 51.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.038 0.447 . . . . 10.0 111.996 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 p -122.83 123.89 69.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.665 -1.235 . . . . 10.0 107.665 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . 0.573 HD13 ' HB3' ' A' ' 61' ' ' GLU . 41.4 mt -93.38 -82.06 0.35 Allowed 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.045 -0.662 . . . . 10.0 112.023 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.6 m -174.19 -167.9 0.36 Allowed 'General case' 0 C--O 1.236 0.388 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.517 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 2.0 mp0 -111.87 134.99 53.07 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 10.0 109.916 178.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -72.73 -175.87 1.82 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.51 66.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.518 0.675 . . . . 10.0 110.211 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -89.7 -3.49 58.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.265 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.94 3.37 79.95 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.234 -0.746 . . . . 10.0 111.234 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.517 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -61.59 108.58 1.0 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.686 0.279 . . . . 10.0 111.483 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' B' ' 43' ' ' THR . 5.5 tpp85 -86.49 99.97 12.04 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.351 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' B' ' 43' ' ' THR . 86.8 mttt -83.18 118.6 23.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.933 0.397 . . . . 10.0 110.761 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -133.91 144.48 48.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.748 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.692 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.9 tp -114.87 107.82 15.93 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -133.76 160.22 38.25 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.984 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' B' ' 29' ' ' ARG . 20.8 ttm180 -95.52 114.23 25.97 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.484 HG12 ' HA ' ' B' ' 9' ' ' ILE . 17.8 m -127.1 158.03 38.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.985 0.421 . . . . 10.0 110.587 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.2 p -97.35 126.05 42.34 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.032 0.444 . . . . 10.0 110.494 179.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -64.21 108.71 1.64 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.492 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.5 m-80 60.34 26.43 15.95 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.836 0.71 . . . . 10.0 110.267 -178.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 67.25 22.29 9.69 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.046 -0.979 . . . . 10.0 110.922 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.41 -75.35 0.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.062 -0.399 . . . . 10.0 111.429 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -98.86 118.78 62.38 Favored Pre-proline 0 C--N 1.33 -0.264 0 N-CA-C 111.71 0.263 . . . . 10.0 111.71 -178.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 61.7 Cg_endo -77.89 120.77 5.18 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.781 2.32 . . . . 10.0 111.514 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.43 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 21.1 ttmm -143.1 169.98 16.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . 0.43 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 22.4 m-85 -93.55 128.95 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.716 0.293 . . . . 10.0 110.556 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -141.43 132.39 26.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.692 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.5 tt -110.71 122.07 64.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.257 0.551 . . . . 10.0 110.013 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.442 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.7 mtt85 -144.18 -179.74 6.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.209 -177.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.581 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.17 143.41 50.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.138 179.853 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -117.82 171.37 8.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.022 -0.536 . . . . 10.0 109.664 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -68.44 157.04 89.12 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -22.15 70.45 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.414 2.076 . . . . 10.0 111.859 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -100.72 0.07 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.13 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 58.34 30.05 19.02 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.075 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.1 -39.96 28.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.094 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -135.44 174.5 10.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 10.0 111.516 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -134.57 172.47 12.88 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.949 -1.023 . . . . 10.0 110.533 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.34 -161.95 9.01 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.127 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -99.44 147.08 25.65 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.989 -0.713 . . . . 10.0 112.142 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.431 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -141.98 -124.44 1.96 Allowed Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.144 -0.934 . . . . 10.0 110.777 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -145.82 146.46 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 117.556 0.678 . . . . 10.0 110.807 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.9 m -107.79 139.89 41.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.197 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.3 mt -124.25 132.29 53.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.234 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.23 166.78 22.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.179 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.26 -40.78 96.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.677 -0.238 . . . . 10.0 111.288 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.516 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.4 pt-20 -63.76 -44.74 92.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.421 . . . . 10.0 110.511 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.445 ' OE2' ' HD2' ' A' ' 25' ' ' LYS . 36.1 mt-10 -66.47 -46.85 74.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.608 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.451 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.5 t80 -58.23 -39.26 78.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.438 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.61 -49.72 75.47 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.203 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 60' ' ' GLU . 8.2 t -66.5 -43.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.044 0.449 . . . . 10.0 110.432 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.3 tp -56.27 -54.73 41.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.887 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.572 ' HB3' HD11 ' A' ' 73' ' ' LEU . 48.9 mt -61.19 -47.82 84.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.126 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -50.49 -53.59 28.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.689 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.682 ' HB3' HD12 ' A' ' 14' ' ' ILE . 27.8 mm-40 -69.5 -47.17 64.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.844 -178.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.501 ' HB3' HD22 ' A' ' 66' ' ' LEU . 70.6 mt -60.13 -41.2 92.18 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.752 0.279 . . . . 10.0 111.752 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.21 -36.27 92.65 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.603 -0.808 . . . . 10.0 111.267 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -74.05 -29.66 62.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.077 0.465 . . . . 10.0 110.775 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 38.6 mmtt -65.56 -26.45 67.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.611 HD11 ' CB ' ' A' ' 66' ' ' LEU . 27.0 mt -89.44 3.24 52.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.694 0.283 . . . . 10.0 111.558 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.254 1.29 0 CA-C-O 118.567 -0.73 . . . . 10.0 110.105 179.694 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.8 mtm . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 120.879 0.371 . . . . 10.0 110.539 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.12 160.29 14.39 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.416 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 13.0 t70 -62.19 -57.32 11.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 39.1 mmtm -138.29 94.29 2.85 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.7 137.8 58.02 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.6 tppt? -71.75 134.29 46.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.148 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -159.58 170.12 22.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.006 179.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.444 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.13 133.52 11.81 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.285 -0.416 . . . . 10.0 109.938 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 70.7 mt -80.74 110.48 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.107 0.479 . . . . 10.0 110.418 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.426 HG13 ' HB3' ' A' ' 37' ' ' PRO . 33.4 mm -82.8 -39.61 15.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.215 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -167.3 139.35 3.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.841 -179.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.15 137.08 32.93 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 53.1 mt -104.55 -76.01 0.61 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.488 -0.485 . . . . 10.0 110.828 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.796 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.6 mm -134.92 134.22 53.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.222 0.534 . . . . 10.0 111.848 -178.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.418 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -114.63 121.93 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 177.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' B' ' 61' ' ' GLU . 32.0 mt -89.38 -80.67 0.3 Allowed 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.496 -0.482 . . . . 10.0 111.837 -177.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.2 m -179.64 -168.57 0.12 Allowed 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.293 0.371 . . . . 10.0 110.058 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.1 mp0 -110.49 146.33 36.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.402 ' CG ' ' H ' ' A' ' 20' ' ' ALA . 11.9 t-20 -89.55 -168.82 2.27 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.132 -0.692 . . . . 10.0 109.132 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.402 ' H ' ' CG ' ' A' ' 19' ' ' ASN . . . -64.28 -26.42 68.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.481 0.658 . . . . 10.0 111.006 -178.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -85.94 -0.14 54.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.218 -0.901 . . . . 10.0 110.837 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.25 2.98 90.37 Favored Glycine 0 N--CA 1.444 -0.773 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -58.56 108.89 0.69 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 111.467 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.5 tpp85 -79.96 108.93 13.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.17 178.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.564 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 61.5 mttt -88.89 109.82 20.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.194 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.418 ' HG2' HG23 ' A' ' 15' ' ' VAL . 48.2 mt-10 -133.28 149.3 51.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.627 0.727 . . . . 10.0 112.412 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.853 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.4 tp -122.36 108.54 13.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.518 -1.219 . . . . 10.0 107.882 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -134.16 166.28 23.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.304 0.574 . . . . 10.0 111.961 -177.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 29' ' ' ARG . 6.3 ttm180 -98.71 114.33 26.8 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.6 m -128.71 156.83 41.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.761 0.315 . . . . 10.0 110.651 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.444 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.8 OUTLIER -93.51 123.91 37.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.252 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -64.4 108.82 1.73 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.784 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.404 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 60.74 30.3 19.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.932 -178.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t0 66.29 18.77 10.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.669 -1.151 . . . . 10.0 111.206 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.26 -93.1 0.28 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.599 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -84.94 126.59 67.61 Favored Pre-proline 0 C--O 1.233 0.22 0 CA-C-O 120.582 0.23 . . . . 10.0 111.593 -179.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.426 ' HB3' HG13 ' A' ' 10' ' ' ILE . 71.6 Cg_endo -81.0 120.42 3.76 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.042 2.495 . . . . 10.0 111.818 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -139.36 167.04 22.97 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -92.52 129.93 38.32 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.506 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t0 -139.88 132.94 29.53 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.892 -0.411 . . . . 10.0 109.892 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.853 ' HB ' HD13 ' A' ' 27' ' ' LEU . 13.7 tt -109.33 122.01 63.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.506 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.91 170.87 15.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.508 0.67 . . . . 10.0 112.103 -177.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.564 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.32 131.49 55.93 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 114.881 -1.054 . . . . 10.0 110.205 179.458 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -117.43 176.7 5.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.255 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.88 156.71 84.31 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -55.3 -37.5 94.47 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.729 2.286 . . . . 10.0 112.557 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -94.22 3.57 55.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.239 0.542 . . . . 10.0 110.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.8 m170 61.09 26.32 16.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.618 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.18 -35.06 77.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.728 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 50' ' ' LYS . 36.4 mmtm -141.76 174.42 10.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.533 . . . . 10.0 111.291 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.88 172.29 11.84 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.457 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.93 -175.28 14.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.813 -0.708 . . . . 10.0 112.461 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -91.85 139.03 31.06 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.427 -0.455 . . . . 10.0 111.901 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.4 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -138.77 -121.2 1.9 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.369 -0.832 . . . . 10.0 111.174 179.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.3 tt -150.67 143.73 17.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.335 0.568 . . . . 10.0 111.012 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -104.39 135.59 45.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.53 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.8 mt -113.9 121.99 45.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.58 176.92 9.26 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.8 -0.36 . . . . 10.0 110.448 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.78 -41.5 91.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.192 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.495 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 13.4 pt-20 -56.14 -47.88 77.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.336 0.589 . . . . 10.0 110.739 178.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.495 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 30.1 mt-10 -67.16 -60.18 2.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.329 -0.851 . . . . 10.0 111.663 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.621 ' CE2' HD11 ' A' ' 66' ' ' LEU . 5.1 t80 -48.29 -45.11 34.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.235 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.69 34.85 Favored Glycine 0 C--O 1.237 0.313 0 C-N-CA 121.389 -0.434 . . . . 10.0 113.264 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.9 t -69.58 -43.62 80.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.736 0.303 . . . . 10.0 111.419 -179.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.96 -52.45 65.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.431 -178.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.628 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.3 mt -62.93 -46.15 89.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 120.788 -0.365 . . . . 10.0 111.465 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -52.32 -50.42 62.29 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.598 0.562 . . . . 10.0 110.906 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.658 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 34.6 mm-40 -70.55 -50.15 40.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.813 -0.631 . . . . 10.0 111.947 -179.045 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 mt -55.89 -47.49 77.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.574 0.226 . . . . 10.0 111.58 -179.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.93 -31.22 80.21 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.601 -0.809 . . . . 10.0 111.592 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -74.37 -32.85 62.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.64 0.257 . . . . 10.0 111.116 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.658 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 33.3 mmtt -70.22 -24.24 63.06 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.71 0.29 . . . . 10.0 110.971 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' B' ' 66' ' ' LEU . 22.5 mt -85.05 -6.46 59.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.113 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.442 -0.79 . . . . 10.0 110.634 -179.542 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.871 0.367 . . . . 10.0 110.23 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.82 163.82 14.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -68.93 -55.12 11.98 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -137.94 93.24 2.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.934 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -63.91 139.82 58.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.376 . . . . 10.0 110.656 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -74.33 134.88 42.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.852 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -161.31 171.31 18.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.491 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -156.48 131.59 9.18 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -78.53 108.61 12.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.239 0.543 . . . . 10.0 110.534 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' B' ' 37' ' ' PRO . 24.5 mm -80.8 -40.52 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.936 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -166.79 138.91 3.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.621 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -84.22 139.63 32.23 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.4 mt -108.05 -73.42 0.69 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.433 -0.507 . . . . 10.0 111.274 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.589 HD12 ' HB3' ' A' ' 68' ' ' GLU . 14.7 mm -136.13 132.62 50.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.815 0.34 . . . . 10.0 111.761 -178.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.441 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -114.05 122.29 67.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 107.578 -1.268 . . . . 10.0 107.578 176.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.7 mt -88.31 -81.13 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.429 -0.509 . . . . 10.0 111.83 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 179.06 -169.21 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.543 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 11.5 mp0 -109.56 145.68 35.94 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.072 -0.344 . . . . 10.0 110.072 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -88.09 -168.28 2.16 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.62 -22.27 66.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.192 0.52 . . . . 10.0 111.155 -179.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -91.02 1.8 56.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 0.95 90.08 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.111 -0.796 . . . . 10.0 111.111 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -56.53 109.39 0.61 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.576 -0.312 . . . . 10.0 111.697 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.3 tpp85 -80.03 110.63 15.6 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.525 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 61.0 mttt -90.04 110.86 21.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.394 -179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.441 ' HG2' HG23 ' B' ' 15' ' ' VAL . 48.1 mt-10 -134.74 150.37 50.56 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.627 0.727 . . . . 10.0 112.333 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.81 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.3 tp -123.97 108.9 12.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.556 -1.202 . . . . 10.0 108.006 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -134.25 166.59 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.18 0.514 . . . . 10.0 111.828 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' B' ' 29' ' ' ARG . 7.2 ttm180 -98.05 113.75 25.72 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.32 -0.992 . . . . 10.0 108.32 178.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.5 m -128.74 155.46 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.887 0.375 . . . . 10.0 110.735 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -93.05 124.89 37.34 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.922 0.391 . . . . 10.0 110.584 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -64.44 109.32 1.9 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.689 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 60.3 29.9 19.39 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.539 0.685 . . . . 10.0 109.779 -178.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 41.7 t0 65.37 22.18 11.98 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.269 -1.332 . . . . 10.0 111.154 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.41 -89.18 0.38 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.488 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -88.79 125.9 61.32 Favored Pre-proline 0 C--O 1.235 0.302 0 CA-C-O 120.705 0.288 . . . . 10.0 111.426 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.423 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.4 Cg_endo -79.07 121.81 5.05 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.804 2.336 . . . . 10.0 111.582 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -140.49 164.31 30.47 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -90.75 127.68 36.41 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.514 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t0 -138.27 134.0 33.81 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.81 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.9 tt -110.21 120.95 62.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.514 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -143.9 169.84 17.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.543 0.687 . . . . 10.0 112.286 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.525 ' CG2' ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -113.21 131.13 56.01 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 114.838 -1.074 . . . . 10.0 110.356 179.467 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m0 -117.5 175.41 5.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.234 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.84 158.04 86.52 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -58.12 -33.02 96.94 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.529 2.152 . . . . 10.0 112.32 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -94.87 1.04 55.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.473 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 24.8 m170 62.28 24.27 14.43 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.284 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -66.99 -38.28 85.75 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.856 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -139.48 174.27 10.69 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.209 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.22 172.76 11.46 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.648 -178.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -139.9 -173.51 13.28 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.518 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 6.8 mtpp -93.64 136.31 34.05 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.243 -0.563 . . . . 10.0 111.863 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.45 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -134.96 -123.01 2.29 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 110.65 -0.98 . . . . 10.0 110.65 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.3 tt -150.43 143.05 17.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.39 0.595 . . . . 10.0 110.798 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.96 134.58 46.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.731 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 46.7 mt -112.69 120.24 40.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.96 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.06 174.97 11.06 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.935 -0.306 . . . . 10.0 110.414 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -58.37 -42.6 87.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.54 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.477 ' O ' HG23 ' B' ' 64' ' ' VAL . 12.1 pt-20 -55.91 -43.83 77.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.387 0.613 . . . . 10.0 110.678 178.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.543 ' HA ' HD13 ' A' ' 16' ' ' LEU . 31.3 mt-10 -70.94 -58.58 3.44 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.365 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 0.8 OUTLIER -52.74 -40.62 63.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.594 -178.425 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.27 -56.33 24.25 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.905 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.518 ' HB ' HD22 ' A' ' 16' ' ' LEU . 13.5 t -68.24 -44.79 83.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.844 0.354 . . . . 10.0 111.366 -179.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.1 tp -57.12 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.531 -178.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.651 ' HB3' HD11 ' A' ' 73' ' ' LEU . 23.4 mt -60.1 -52.74 64.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.6 0.238 . . . . 10.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttm -49.05 -51.71 29.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.642 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.796 ' HB3' HD12 ' A' ' 14' ' ' ILE . 55.2 mm-40 -69.56 -51.31 36.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.124 -0.489 . . . . 10.0 112.092 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.628 ' HB3' HD22 ' A' ' 66' ' ' LEU . 62.4 mt -57.05 -46.16 82.66 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.701 0.26 . . . . 10.0 111.701 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.35 93.28 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.282 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . 0.423 ' HA ' ' HG3' ' B' ' 74' ' ' GLU . 2.0 t-20 -72.06 -30.83 65.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.58 -0.31 . . . . 10.0 111.688 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.677 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 13.9 mmtt -69.36 -25.48 64.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.541 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.579 HD11 ' HB3' ' A' ' 66' ' ' LEU . 19.1 mt -88.62 -2.76 58.76 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.384 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . 0.423 ' HG3' ' HA ' ' B' ' 71' ' ' ASN . 36.6 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.955 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.789 0.328 . . . . 10.0 110.426 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.47 163.53 13.37 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -72.28 -50.86 23.9 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.611 -0.514 . . . . 10.0 109.611 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -134.77 94.57 3.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.887 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.3 tp -68.46 140.53 55.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.463 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.48 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -74.53 131.47 41.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.616 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -158.03 171.83 19.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.393 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.418 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.27 135.19 12.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.346 -0.612 . . . . 10.0 109.346 178.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.425 ' HA ' HG12 ' A' ' 30' ' ' VAL . 65.1 mt -83.38 117.47 29.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 mm -84.95 -49.25 15.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.293 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -165.77 134.17 3.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.263 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -79.47 137.83 37.36 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.276 -0.638 . . . . 10.0 109.276 178.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.572 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 87.9 mt -105.75 -72.1 0.72 Allowed 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.793 -0.363 . . . . 10.0 111.467 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.606 HD12 ' HB3' ' B' ' 68' ' ' GLU . 27.2 mm -131.75 140.86 47.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.094 0.474 . . . . 10.0 111.924 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.76 120.8 58.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 108.11 -1.07 . . . . 10.0 108.11 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.608 HD22 ' HB ' ' B' ' 64' ' ' VAL . 25.6 mt -91.02 -80.77 0.33 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.159 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 179.36 -170.38 0.13 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -106.67 140.08 40.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.817 0.341 . . . . 10.0 110.239 179.004 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -77.48 -174.63 3.43 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.01 -24.47 67.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.536 0.684 . . . . 10.0 110.837 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -90.21 3.02 54.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.155 -0.93 . . . . 10.0 110.692 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.06 6.01 87.01 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.207 -0.757 . . . . 10.0 111.207 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.433 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.6 m0 -62.1 100.33 0.16 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.839 0.352 . . . . 10.0 111.346 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 43' ' ' THR . 13.3 tpp85 -81.12 99.42 8.5 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' A' ' 43' ' ' THR . 89.9 mttt -83.5 112.23 19.78 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.864 0.364 . . . . 10.0 110.52 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -131.55 149.31 52.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.842 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.679 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.3 tp -118.3 108.16 14.76 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.099 -1.075 . . . . 10.0 108.099 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -133.38 160.7 36.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 10.0 111.152 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 29' ' ' ARG . 32.6 ttm180 -96.79 114.97 26.65 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' A' ' 9' ' ' ILE . 17.2 m -127.92 160.47 37.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.801 0.334 . . . . 10.0 110.569 -179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.6 p -96.58 122.53 39.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.926 0.393 . . . . 10.0 110.453 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -64.2 109.97 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.014 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.2 m-80 59.12 31.0 20.91 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.781 0.676 . . . . 10.0 110.158 -178.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t70 61.61 30.06 18.47 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.763 -1.108 . . . . 10.0 110.959 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.75 -77.83 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.058 -0.402 . . . . 10.0 111.705 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -97.12 120.47 61.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 120.631 0.253 . . . . 10.0 111.589 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.502 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 69.0 Cg_endo -78.62 120.85 4.9 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.484 2.123 . . . . 10.0 111.325 178.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -141.25 168.5 19.62 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.424 ' HD1' HD11 ' A' ' 13' ' ' LEU . 2.8 m-85 -93.26 130.47 38.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.44 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -141.54 130.02 22.56 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.679 ' HB ' HD13 ' A' ' 27' ' ' LEU . 6.4 tt -106.32 121.31 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.345 0.593 . . . . 10.0 109.953 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.44 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.65 177.6 8.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.19 -177.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.581 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -120.77 142.22 49.77 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.497 179.197 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -117.01 176.63 5.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.29 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.431 ' HG ' ' H ' ' A' ' 50' ' ' LYS . 2.3 p -79.39 158.38 74.04 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -58.75 -30.86 93.75 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.53 2.153 . . . . 10.0 112.162 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -94.27 -5.35 46.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.834 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 60.83 34.59 19.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.6 -178.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -88.26 -32.51 18.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.472 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.431 ' H ' ' HG ' ' A' ' 45' ' ' SER . 39.0 mmtm -141.84 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.119 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.443 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -145.42 172.73 12.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.278 -177.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -133.63 -154.82 7.49 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.092 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.4 ' HA ' ' NH2' ' A' ' 42' ' ' ARG . 36.5 mttp -101.58 157.3 16.92 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 122.169 -0.607 . . . . 10.0 112.066 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.81 -122.36 0.99 Allowed Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.775 -0.93 . . . . 10.0 110.775 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -149.38 141.42 17.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 117.759 0.78 . . . . 10.0 111.367 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.51 144.67 31.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -129.79 130.66 45.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.113 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -84.97 175.21 9.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.774 -0.194 . . . . 10.0 110.905 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -53.69 -58.68 6.32 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.49 0.552 . . . . 10.0 112.49 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -57.69 -49.01 77.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.757 0.313 . . . . 10.0 111.829 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -58.99 -49.0 79.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.204 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.666 ' CE2' HD11 ' A' ' 66' ' ' LEU . 25.2 t80 -62.62 -44.07 97.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.486 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.53 -54.56 36.21 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.101 -0.499 . . . . 10.0 112.917 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.448 ' HB ' HD22 ' B' ' 16' ' ' LEU . 53.4 t -60.2 -42.14 89.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.295 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.486 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -57.59 -53.06 62.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.462 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.681 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.2 mt -62.18 -46.14 90.26 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 -179.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -51.27 -51.35 54.99 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 123.635 0.584 . . . . 10.0 111.522 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.605 ' CB ' HD12 ' B' ' 14' ' ' ILE . 49.9 mm-40 -70.24 -46.69 63.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.339 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 69.0 mt -58.53 -44.15 89.47 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 111.682 0.253 . . . . 10.0 111.682 -179.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.57 -38.87 97.09 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.824 -0.703 . . . . 10.0 111.596 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -71.37 -29.05 64.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.813 0.34 . . . . 10.0 110.755 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 54.5 mmtt -66.55 -25.11 66.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.362 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' B' ' 66' ' ' LEU . 24.2 mt -85.68 -11.93 52.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.448 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.706 -0.664 . . . . 10.0 110.635 179.947 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.859 0.361 . . . . 10.0 110.446 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.01 160.57 16.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.416 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 14.8 t70 -72.22 -48.37 43.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.416 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 32.8 mmtm -135.05 94.46 3.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.66 -0.7 . . . . 10.0 109.546 179.006 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 26.9 tp -68.84 140.32 55.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.407 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -74.05 129.72 38.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.597 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -158.01 170.04 23.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.064 -0.517 . . . . 10.0 110.263 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.441 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 6.2 tp10 -152.63 133.05 13.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.506 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.578 ' HA ' HG12 ' B' ' 30' ' ' VAL . 63.7 mt -82.07 117.81 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.093 0.473 . . . . 10.0 110.124 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 39.5 mm -85.24 -50.82 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.377 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 -162.94 133.38 4.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.43 142.64 37.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.1 mt -112.43 -67.95 0.96 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.64 -0.424 . . . . 10.0 111.677 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.605 HD12 ' CB ' ' A' ' 68' ' ' GLU . 21.2 mm -133.03 141.38 44.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.826 0.346 . . . . 10.0 111.787 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -128.31 116.74 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 177.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . 0.448 HD22 ' HB ' ' A' ' 64' ' ' VAL . 34.6 mt -86.14 -81.07 0.22 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.616 -177.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 178.99 -168.48 0.09 Allowed 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.473 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 0.8 OUTLIER -108.39 141.37 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.154 -0.313 . . . . 10.0 110.154 178.841 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -78.82 -172.76 3.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.25 66.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 10.0 110.879 -179.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -93.24 2.74 56.5 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.376 -0.829 . . . . 10.0 110.198 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.43 5.5 84.86 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.664 -0.779 . . . . 10.0 111.436 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.473 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -61.33 101.61 0.18 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.867 0.365 . . . . 10.0 111.641 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' B' ' 43' ' ' THR . 14.1 tpp85 -81.63 99.72 9.03 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.603 ' HG2' HG22 ' B' ' 43' ' ' THR . 90.5 mttt -83.46 113.6 20.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.974 0.416 . . . . 10.0 110.907 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -132.98 148.95 52.27 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.639 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.718 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.8 tp -119.3 107.62 13.62 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 178.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -133.18 161.33 34.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.968 0.413 . . . . 10.0 111.211 -177.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -97.7 114.68 26.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.578 HG12 ' HA ' ' B' ' 9' ' ' ILE . 23.0 m -127.28 159.92 36.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.518 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.2 p -95.01 122.85 38.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 10.0 110.775 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -64.27 110.45 2.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.783 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 65.1 m-80 59.43 29.26 18.8 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.23 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 64.11 24.81 13.58 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.834 -1.075 . . . . 10.0 110.903 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.9 -82.98 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.764 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -92.42 120.41 67.53 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 10.0 111.63 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.2 Cg_endo -76.84 124.05 7.22 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.617 2.212 . . . . 10.0 111.124 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.405 ' HD2' ' CG2' ' B' ' 56' ' ' THR . 22.0 ttmm -144.28 165.94 26.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -92.0 129.52 37.94 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -140.26 130.01 24.45 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.718 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.1 tt -105.53 121.59 57.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 10.0 109.951 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.442 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 2.9 mtt85 -145.04 176.85 9.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.398 -177.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.603 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -120.56 142.2 49.57 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.645 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -116.92 177.34 4.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.028 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -80.97 159.48 68.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.49 -28.79 88.37 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.385 2.056 . . . . 10.0 112.073 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.35 -5.75 42.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.641 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 62.53 28.35 16.68 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.984 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.55 -36.42 29.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.713 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -138.51 172.56 12.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.452 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . 0.432 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -146.78 172.46 13.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.418 -177.761 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.82 -154.67 7.61 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.676 -0.773 . . . . 10.0 112.161 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.51 156.09 17.48 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 122.2 -0.588 . . . . 10.0 111.953 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.1 -121.17 1.11 Allowed Glycine 0 N--CA 1.452 -0.297 0 N-CA-C 110.761 -0.936 . . . . 10.0 110.761 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.2 tt -151.43 141.38 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 117.74 0.77 . . . . 10.0 111.166 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.405 ' CG2' ' HD2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -103.96 145.67 29.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.591 -179.575 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 32.6 mt -128.95 128.83 44.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.272 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -83.57 173.36 11.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.696 -0.229 . . . . 10.0 110.867 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -51.86 -56.6 13.04 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.567 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.5 pt-20 -60.53 -47.09 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.808 0.299 . . . . 10.0 111.808 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.32 -47.44 85.93 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.38 . . . . 10.0 110.974 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -66.14 -40.12 90.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.807 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.07 -53.72 43.25 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.093 -0.503 . . . . 10.0 112.857 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.608 ' HB ' HD22 ' A' ' 16' ' ' LEU . 14.1 t -62.31 -41.7 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 120.979 0.419 . . . . 10.0 110.119 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.2 tp -58.25 -52.44 65.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.453 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.463 ' HB3' HD11 ' A' ' 73' ' ' LEU . 49.6 mt -60.36 -48.71 80.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.331 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -50.34 -53.79 26.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 10.0 111.918 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.606 ' HB3' HD12 ' A' ' 14' ' ' ILE . 65.5 mm-40 -69.79 -47.32 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.015 -0.538 . . . . 10.0 111.933 -178.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.681 ' HB3' HD22 ' A' ' 66' ' ' LEU . 59.9 mt -59.91 -44.29 94.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.904 0.335 . . . . 10.0 111.904 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.16 -36.48 93.02 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.466 -0.873 . . . . 10.0 111.289 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.46 -28.39 61.02 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.699 0.285 . . . . 10.0 111.153 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.8 mmtt -65.45 -24.46 67.18 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 111.968 0.359 . . . . 10.0 111.968 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.647 HD11 ' HB3' ' A' ' 66' ' ' LEU . 23.2 mt -88.85 -4.28 58.52 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.722 -0.391 . . . . 10.0 111.53 -179.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.644 -0.694 . . . . 10.0 110.116 179.35 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mmt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.976 0.417 . . . . 10.0 110.265 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.33 172.17 6.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.273 -0.421 . . . . 10.0 109.917 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.581 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 32.2 t70 -76.86 -57.0 4.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.011 0.434 . . . . 10.0 110.001 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.581 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 38.5 mmtm -135.42 95.38 3.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.873 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.52 141.76 58.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.801 0.334 . . . . 10.0 110.532 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -77.21 131.7 38.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.221 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -155.43 174.25 15.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.501 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.552 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.52 127.07 7.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.908 179.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.427 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.6 mt -81.54 111.81 18.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.141 0.496 . . . . 10.0 109.727 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.447 HG13 ' HB3' ' A' ' 37' ' ' PRO . 29.8 mm -80.28 -50.89 16.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.506 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -159.86 130.31 5.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.418 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -74.44 142.61 44.92 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 73.4 mt -110.64 -75.18 0.63 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.294 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.713 HD12 ' HB3' ' B' ' 68' ' ' GLU . 27.8 mm -132.45 140.96 46.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.227 0.537 . . . . 10.0 112.146 -177.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.86 123.58 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 107.962 -1.125 . . . . 10.0 107.962 177.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.598 HD22 ' HB ' ' B' ' 64' ' ' VAL . 31.0 mt -94.65 -81.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.531 -0.468 . . . . 10.0 112.208 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 m -176.34 -168.38 0.25 Allowed 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.427 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -106.6 147.56 29.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.754 179.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -83.61 -172.78 4.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.19 -26.22 68.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.819 0.819 . . . . 10.0 109.911 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -88.67 -0.6 57.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.739 -1.118 . . . . 10.0 111.025 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.76 5.1 81.86 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.619 -0.8 . . . . 10.0 111.5 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.427 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -62.41 106.76 0.8 Allowed 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.866 0.365 . . . . 10.0 111.187 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.5 tpp85 -82.94 100.06 10.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.551 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.683 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.3 mttt -81.39 116.57 21.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.881 0.372 . . . . 10.0 110.56 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -132.97 152.24 51.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.084 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.656 HD13 ' HB ' ' A' ' 41' ' ' ILE . 46.3 tp -121.28 108.16 13.39 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 107.79 -1.189 . . . . 10.0 107.79 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -132.17 159.57 38.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 10.0 110.794 -178.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -96.9 113.65 25.2 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.284 -1.006 . . . . 10.0 108.284 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.427 HG12 ' HA ' ' A' ' 9' ' ' ILE . 11.4 m -127.37 158.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.776 0.322 . . . . 10.0 110.894 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.552 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -95.83 125.03 40.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.633 179.103 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.9 m0 -64.23 107.61 1.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.674 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.2 m-80 61.21 31.12 19.54 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.513 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.9 t0 66.33 17.08 10.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.056 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.82 -85.08 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.087 -0.383 . . . . 10.0 111.818 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -96.18 122.61 57.54 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 111.922 0.342 . . . . 10.0 111.922 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.504 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.7 Cg_endo -77.27 125.3 7.7 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.067 2.511 . . . . 10.0 111.676 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -143.35 167.98 20.88 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -93.96 126.38 39.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.209 -0.293 . . . . 10.0 110.209 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.45 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -138.27 133.2 32.81 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.656 ' HB ' HD13 ' A' ' 27' ' ' LEU . 14.5 tt -108.2 121.25 60.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.353 0.597 . . . . 10.0 109.956 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.45 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 2.9 mtt85 -144.44 -179.84 6.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.234 -177.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.683 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -123.73 145.38 49.05 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.688 179.267 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.5 m95 -117.48 168.44 10.38 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.96 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.1 m -66.79 157.74 82.68 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 178.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -51.7 -31.7 42.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.093 2.529 . . . . 10.0 113.28 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -107.5 11.92 28.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.226 0.536 . . . . 10.0 110.459 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 54.3 m80 59.03 25.36 13.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.949 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -73.84 -39.67 63.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.734 0.302 . . . . 10.0 111.084 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -133.51 175.42 9.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.316 0.579 . . . . 10.0 111.087 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -140.43 172.78 12.25 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.497 -178.31 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.44 -161.55 8.85 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.583 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -97.77 146.0 25.82 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 122.279 -0.542 . . . . 10.0 112.331 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.443 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -143.15 -126.99 2.08 Favored Glycine 0 CA--C 1.519 0.299 0 N-CA-C 111.097 -0.801 . . . . 10.0 111.097 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 tt -146.77 142.93 20.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 117.888 0.844 . . . . 10.0 111.519 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.0 144.66 30.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.785 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.1 mt -123.77 131.38 53.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.573 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -77.92 171.67 14.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.943 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -64.54 -46.54 82.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.506 0.193 . . . . 10.0 111.248 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.17 -43.8 95.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.231 0.539 . . . . 10.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.413 ' HB3' HD13 ' B' ' 16' ' ' LEU . 74.0 mt-10 -65.28 -52.66 52.8 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.113 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 66' ' ' LEU . 21.1 t80 -56.25 -43.72 78.98 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.343 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.68 -54.11 39.75 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.14 -0.552 . . . . 10.0 112.729 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 89.4 t -62.22 -42.47 95.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.768 0.318 . . . . 10.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.461 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 14.9 tp -58.53 -52.58 65.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.402 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.704 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.4 mt -61.87 -46.05 91.13 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.483 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -51.54 -52.82 43.93 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 123.456 0.473 . . . . 10.0 111.194 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.538 ' CB ' HD12 ' B' ' 14' ' ' ILE . 70.6 mm-40 -68.68 -46.75 68.23 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.711 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 79.9 mt -60.14 -43.67 95.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.683 0.277 . . . . 10.0 111.411 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.61 -33.99 88.73 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.72 -0.753 . . . . 10.0 111.346 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -73.98 -28.37 61.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.882 0.373 . . . . 10.0 110.786 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.64 -27.5 66.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.967 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' B' ' 66' ' ' LEU . 42.0 mt -90.0 -5.25 56.85 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.735 0.272 . . . . 10.0 111.735 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.656 -0.687 . . . . 10.0 110.665 -179.705 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.931 0.396 . . . . 10.0 109.976 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.53 168.18 9.43 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.448 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 36.1 t70 -76.49 -53.32 8.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.055 0.455 . . . . 10.0 110.078 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.448 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 38.2 mmtm -136.29 94.54 3.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.685 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 25.6 tp -65.4 139.26 58.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.856 0.36 . . . . 10.0 110.602 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.474 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.2 tppt? -75.58 130.69 39.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.57 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -153.94 174.3 14.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.196 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.524 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.8 tp10 -155.11 122.37 5.56 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.806 179.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.498 ' HA ' HG12 ' B' ' 30' ' ' VAL . 44.7 mt -77.65 109.83 12.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' B' ' 37' ' ' PRO . 28.6 mm -79.01 -51.83 16.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.664 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -158.87 127.97 5.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.265 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -72.26 145.06 48.16 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 53.1 mt -113.29 -72.12 0.72 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.488 -179.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.538 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.9 mm -133.17 140.63 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 10.0 112.052 -177.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' B' ' 26' ' ' GLU . 4.6 p -123.48 123.77 68.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 107.969 -1.123 . . . . 10.0 107.969 177.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 61' ' ' GLU . 30.5 mt -94.92 -81.19 0.4 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.473 -0.491 . . . . 10.0 112.012 -177.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.46 -168.42 0.15 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 -179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -106.87 147.57 29.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 10.0 110.271 179.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -83.69 -168.0 1.94 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.141 -0.482 . . . . 10.0 109.75 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.1 -23.45 64.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.282 0.563 . . . . 10.0 110.356 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -91.78 1.03 57.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.419 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.82 4.66 82.19 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.51 -0.852 . . . . 10.0 111.636 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -61.94 106.16 0.67 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.742 0.306 . . . . 10.0 110.973 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' B' ' 43' ' ' THR . 7.9 tpp85 -83.02 100.43 10.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.809 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.713 ' HG2' HG22 ' B' ' 43' ' ' THR . 93.3 mttt -81.03 116.97 21.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 10.0 110.891 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.443 ' HG2' HG23 ' B' ' 15' ' ' VAL . 66.9 mt-10 -132.57 150.39 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.937 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.632 HD13 ' HB ' ' B' ' 41' ' ' ILE . 41.2 tp -120.14 107.94 13.63 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.95 -1.13 . . . . 10.0 107.95 178.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -133.27 158.0 44.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.939 0.4 . . . . 10.0 111.159 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -94.93 114.0 25.79 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.414 -0.958 . . . . 10.0 108.414 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.498 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.2 m -128.16 156.15 40.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.362 . . . . 10.0 110.883 -178.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.524 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.7 OUTLIER -95.11 125.58 39.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.033 0.444 . . . . 10.0 110.626 179.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 10.5 m0 -64.24 110.11 2.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.956 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.474 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.7 m-80 60.6 28.71 18.41 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.667 0.604 . . . . 10.0 110.356 -178.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 40.4 t0 62.66 32.22 16.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.037 -0.983 . . . . 10.0 110.214 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.62 -82.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.025 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -98.16 122.38 54.35 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-O 120.646 0.26 . . . . 10.0 111.515 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.505 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 70.3 Cg_endo -77.12 121.78 5.92 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.809 2.339 . . . . 10.0 111.654 178.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.407 ' HD2' ' CG2' ' B' ' 56' ' ' THR . 19.7 ttmm -139.75 167.5 21.96 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -95.04 126.83 40.65 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.467 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -138.15 132.82 32.52 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.611 -0.515 . . . . 10.0 109.611 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.632 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.9 tt -106.44 121.76 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.183 0.516 . . . . 10.0 109.73 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.467 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -144.87 178.48 7.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.268 0.556 . . . . 10.0 111.599 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.713 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -121.86 145.0 48.51 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.573 -0.739 . . . . 10.0 109.743 179.453 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -117.73 167.09 11.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.673 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 16.6 m -66.35 157.98 79.69 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.504 -0.554 . . . . 10.0 109.504 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -51.48 -33.24 46.48 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.975 2.45 . . . . 10.0 112.908 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -105.1 11.29 33.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.102 0.477 . . . . 10.0 110.91 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.2 m80 57.76 27.66 14.75 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.38 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.23 -39.85 59.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.825 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -134.68 175.17 9.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 10.0 111.132 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . 0.423 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -141.19 172.63 12.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.257 -0.883 . . . . 10.0 110.363 -178.111 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -138.63 -159.97 8.25 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.566 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -97.41 146.47 25.16 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.184 -0.598 . . . . 10.0 112.241 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.426 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -142.4 -129.02 2.34 Favored Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -147.48 140.9 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 117.666 0.733 . . . . 10.0 111.22 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.407 ' CG2' ' HD2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -100.83 147.92 25.54 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.16 -179.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 87.6 mt -126.52 132.94 51.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.383 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -79.92 169.52 17.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.27 -47.95 83.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 10.0 111.145 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.645 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.5 pt-20 -58.57 -44.31 89.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.608 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.463 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 65.6 mt-10 -66.48 -52.73 43.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.023 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.49 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.1 t80 -57.16 -41.56 79.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.858 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.75 -53.46 45.79 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.27 -0.491 . . . . 10.0 112.84 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.645 HG23 ' O ' ' B' ' 60' ' ' GLU . 15.6 t -62.97 -43.51 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.877 0.37 . . . . 10.0 110.503 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.1 tp -58.33 -51.98 67.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.358 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.573 ' HB3' HD11 ' A' ' 73' ' ' LEU . 62.1 mt -60.1 -49.61 76.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.812 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -50.74 -54.62 21.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.661 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.713 ' HB3' HD12 ' A' ' 14' ' ' ILE . 39.6 mm-40 -67.42 -47.57 69.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.053 -0.521 . . . . 10.0 112.027 -178.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.643 ' HB3' HD22 ' A' ' 66' ' ' LEU . 72.5 mt -61.75 -42.12 98.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.5 0.19 . . . . 10.0 111.455 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.73 -37.37 94.71 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -72.02 -28.81 63.62 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.023 0.44 . . . . 10.0 110.911 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.5 mmtt -64.44 -32.27 73.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.065 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.539 HD11 ' CB ' ' A' ' 66' ' ' LEU . 24.9 mt -90.66 6.06 45.49 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.794 -0.622 . . . . 10.0 109.788 179.209 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 mmt . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 120.889 0.376 . . . . 10.0 110.175 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 168.29 10.45 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.115 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.96 -58.22 3.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -135.95 105.19 5.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.0 tp -78.26 143.28 37.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 10.0 110.423 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -78.63 139.41 38.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.968 0.413 . . . . 10.0 111.268 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 p90 -162.84 175.92 10.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.608 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.44 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.9 tp10 -160.13 131.14 5.73 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.8 mt -80.38 112.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.785 0.326 . . . . 10.0 110.208 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.2 mm -85.48 -39.47 13.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.657 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -165.8 127.25 1.91 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.571 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.55 142.63 37.2 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 178.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.465 ' O ' HD13 ' A' ' 14' ' ' ILE . 72.2 mt -111.43 -74.47 0.64 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.559 -0.457 . . . . 10.0 111.627 -178.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.668 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.1 mm -129.41 144.57 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.143 0.497 . . . . 10.0 111.855 -177.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.401 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.6 p -128.56 126.52 65.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.653 HD13 ' HA ' ' B' ' 61' ' ' GLU . 36.0 mt -95.33 -80.57 0.41 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.704 -0.398 . . . . 10.0 111.249 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 m 175.82 -173.93 0.09 Allowed 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.378 0.671 . . . . 10.0 109.487 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.492 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -99.58 151.86 20.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.293 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -94.18 -173.33 3.06 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.07 -26.4 67.61 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.639 0.733 . . . . 10.0 110.811 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -89.17 3.09 53.09 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.022 -0.99 . . . . 10.0 110.719 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.36 -1.54 88.55 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.817 -0.706 . . . . 10.0 111.466 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.499 ' HB3' ' CG2' ' A' ' 43' ' ' THR . 40.2 m0 -56.13 107.05 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.987 0.366 . . . . 10.0 111.987 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 tpp85 -80.18 108.74 14.03 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.537 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 78.9 mttt -85.46 112.0 20.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.292 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.401 ' HG2' HG23 ' A' ' 15' ' ' VAL . 50.3 mt-10 -138.59 155.44 48.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.667 0.746 . . . . 10.0 112.122 -179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.801 HD13 ' HB ' ' A' ' 41' ' ' ILE . 36.4 tp -127.7 110.4 12.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.668 -1.151 . . . . 10.0 108.393 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.04 162.77 31.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.05 0.453 . . . . 10.0 111.795 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -94.84 114.72 26.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 178.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.4 m -129.54 156.74 42.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.974 0.416 . . . . 10.0 111.246 -179.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.5 p -96.83 122.3 39.65 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.04 0.447 . . . . 10.0 110.627 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -63.92 111.23 2.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.962 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 58.93 27.97 16.95 Favored 'General case' 0 N--CA 1.463 0.179 0 O-C-N 123.806 0.691 . . . . 10.0 110.44 -178.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.1 t70 64.76 25.64 12.97 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.232 -0.895 . . . . 10.0 110.891 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.69 -80.22 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.335 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -98.32 123.74 49.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.541 0.21 . . . . 10.0 111.41 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 74.4 Cg_endo -81.05 123.86 4.72 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.997 2.464 . . . . 10.0 111.685 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -143.85 168.69 19.35 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.87 136.77 32.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.58 129.33 15.18 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.801 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -108.73 122.62 63.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.251 0.548 . . . . 10.0 109.579 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.445 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.1 mtt85 -146.45 176.16 10.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.42 0.629 . . . . 10.0 111.977 -177.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.537 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -117.38 131.28 56.8 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 114.799 -1.091 . . . . 10.0 109.718 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.0 m0 -117.26 177.52 4.7 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.757 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -72.96 155.39 90.52 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.57 -24.07 70.19 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.195 1.93 . . . . 10.0 112.068 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -98.05 -0.86 43.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.861 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.2 m170 61.34 20.88 11.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.405 -0.816 . . . . 10.0 110.703 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.42 ' H ' ' HG2' ' A' ' 49' ' ' GLU . 12.2 pt-20 -71.7 -39.34 70.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.033 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -135.35 174.3 10.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.224 0.535 . . . . 10.0 111.194 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.74 171.79 13.61 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.183 -0.917 . . . . 10.0 110.407 -177.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.91 -161.74 8.99 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.637 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.5 mttp -99.94 145.87 27.33 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -145.41 -121.01 1.38 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 111.08 -0.808 . . . . 10.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 12.7 tt -148.84 142.55 18.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.521 0.66 . . . . 10.0 111.14 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -101.73 136.84 40.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.833 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.4 mt -117.09 120.48 38.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.925 0.393 . . . . 10.0 110.27 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.502 ' HB3' ' HG2' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -80.6 172.49 13.69 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.502 179.586 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -58.22 -43.05 87.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 10.0 111.503 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.572 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.2 pt-20 -54.44 -47.38 72.95 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.39 0.614 . . . . 10.0 110.509 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.572 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 26.7 mt-10 -68.23 -58.64 4.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.052 -0.977 . . . . 10.0 111.326 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.629 ' CE2' HD11 ' A' ' 66' ' ' LEU . 10.1 t80 -49.82 -44.83 49.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.401 -0.818 . . . . 10.0 111.867 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.87 -58.5 13.42 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.229 -0.51 . . . . 10.0 113.181 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -65.17 -40.93 90.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.883 0.373 . . . . 10.0 111.296 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.477 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.1 tp -58.24 -53.84 53.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.958 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.629 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.1 mt -61.92 -43.84 98.01 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.106 -0.237 . . . . 10.0 111.356 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.1 tttm -50.76 -53.31 32.75 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 123.616 0.572 . . . . 10.0 111.07 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.514 ' CB ' HD12 ' B' ' 14' ' ' ILE . 25.2 mm-40 -72.07 -44.56 63.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.706 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 44.0 mt -59.43 -44.0 92.98 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.424 0.157 . . . . 10.0 111.424 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.4 94.67 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.459 -0.876 . . . . 10.0 110.987 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.75 -28.15 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.702 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 72.3 mmtt -68.54 -30.7 69.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.285 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.499 HD11 ' HB3' ' B' ' 66' ' ' LEU . 19.4 mt -88.49 2.56 52.62 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.243 -0.183 . . . . 10.0 111.419 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.471 -0.776 . . . . 10.0 110.309 179.857 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.3 mmt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.915 0.388 . . . . 10.0 110.18 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.24 163.47 13.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.322 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.426 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 4.6 t70 -66.32 -60.37 2.83 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.426 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 35.1 mmtm -132.5 104.64 6.79 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 37.3 tp -77.56 142.71 38.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.814 0.34 . . . . 10.0 110.692 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -79.36 136.27 36.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.078 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -160.11 174.77 13.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.681 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.449 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 13.5 tp10 -158.64 126.57 5.14 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.059 -0.348 . . . . 10.0 110.059 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.403 ' HA ' HG12 ' B' ' 30' ' ' VAL . 71.9 mt -76.0 114.55 16.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.064 0.459 . . . . 10.0 110.156 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 32.0 mm -86.99 -41.26 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.428 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -164.48 127.53 2.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.771 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -76.52 142.89 40.72 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.4 mt -111.75 -72.55 0.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.521 -0.472 . . . . 10.0 111.861 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.514 HD12 ' CB ' ' A' ' 68' ' ' GLU . 21.5 mm -131.5 144.2 38.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 10.0 111.496 -177.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.415 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -129.16 123.36 58.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 177.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 26.5 mt -92.3 -80.81 0.36 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.905 -0.318 . . . . 10.0 111.445 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 176.59 -172.05 0.09 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.302 0.641 . . . . 10.0 109.386 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.447 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.9 mp0 -101.34 150.87 22.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . 0.4 ' CG ' ' H ' ' B' ' 20' ' ' ALA . 18.0 t-20 -90.91 -174.51 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.781 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . 0.4 ' H ' ' CG ' ' B' ' 19' ' ' ASN . . . -63.82 -23.83 67.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.453 0.644 . . . . 10.0 110.596 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -91.06 1.49 57.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.287 -0.869 . . . . 10.0 110.314 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.34 -1.21 87.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.389 -178.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.511 ' HB3' ' CG2' ' B' ' 43' ' ' THR . 40.3 m0 -56.68 107.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.61 109.58 15.27 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . 0.445 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 80.8 mttt -86.36 111.58 20.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.611 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.415 ' HG2' HG23 ' B' ' 15' ' ' VAL . 50.2 mt-10 -138.21 157.14 46.88 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.568 0.699 . . . . 10.0 112.138 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.784 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.4 tp -128.88 111.02 12.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.742 -1.117 . . . . 10.0 108.192 178.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -135.57 161.03 36.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.037 0.446 . . . . 10.0 111.435 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 ttm-85 -93.03 114.67 27.29 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.35 -0.981 . . . . 10.0 108.35 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' B' ' 9' ' ' ILE . 18.3 m -128.87 154.99 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.948 0.404 . . . . 10.0 111.076 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.499 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.5 p -95.63 122.72 38.69 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.972 0.415 . . . . 10.0 110.513 179.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -63.99 112.39 2.93 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.82 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 57.58 28.13 15.18 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.708 0.63 . . . . 10.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 62.95 30.45 16.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.963 -1.017 . . . . 10.0 110.884 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.77 -79.07 0.58 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.102 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -99.05 122.06 53.66 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.532 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 65.7 Cg_endo -79.78 122.52 4.94 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.716 2.277 . . . . 10.0 111.709 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -142.99 166.57 24.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -87.41 135.65 33.25 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.5 t0 -147.41 128.57 14.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.784 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.1 tt -107.34 123.25 62.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.426 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -146.23 175.05 10.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.494 0.664 . . . . 10.0 112.119 -177.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.511 ' CG2' ' HB3' ' B' ' 23' ' ' TRP . 0.0 OUTLIER -117.45 131.59 56.71 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.728 -1.124 . . . . 10.0 109.887 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 18.0 m0 -117.56 177.99 4.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.56 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.9 m -74.21 155.44 88.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.17 -31.21 89.87 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.073 1.849 . . . . 10.0 112.145 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.14 -3.8 57.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.195 179.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 m170 64.15 24.7 13.52 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.489 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.68 -39.64 61.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.138 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -133.97 174.3 10.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.136 0.493 . . . . 10.0 110.834 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.74 168.82 18.94 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.573 -177.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.04 -163.79 10.23 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.704 -0.76 . . . . 10.0 112.664 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mttp -98.59 144.84 27.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.38 0.511 . . . . 10.0 112.38 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.52 -118.54 1.31 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.8 tt -152.56 142.35 14.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.413 0.607 . . . . 10.0 110.919 179.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.6 m -102.44 135.42 44.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.475 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 68.8 mt -115.75 121.23 41.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.871 0.367 . . . . 10.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.9 m -80.45 174.01 12.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.582 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -59.26 -40.78 87.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.838 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 8.5 pt-20 -55.55 -46.67 77.11 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.606 0.717 . . . . 10.0 110.432 178.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.653 ' HA ' HD13 ' A' ' 16' ' ' LEU . 31.6 mt-10 -68.54 -58.62 4.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.021 -0.991 . . . . 10.0 111.202 -179.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -53.83 -39.18 65.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.822 -178.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.32 -59.65 9.59 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.918 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.589 ' HB ' HD22 ' A' ' 16' ' ' LEU . 8.9 t -67.19 -41.04 86.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.627 0.251 . . . . 10.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.58 -53.59 56.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.094 -179.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.499 ' HB3' HD11 ' A' ' 73' ' ' LEU . 45.3 mt -59.01 -49.12 79.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.238 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -50.19 -54.19 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.662 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.668 ' HB3' HD12 ' A' ' 14' ' ' ILE . 21.7 mm-40 -69.38 -46.53 66.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.856 -0.611 . . . . 10.0 112.056 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.615 ' HB3' HD22 ' A' ' 66' ' ' LEU . 46.8 mt -60.57 -43.86 96.82 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.04 94.11 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.717 -0.953 . . . . 10.0 110.717 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.19 -23.6 61.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.365 -0.418 . . . . 10.0 111.185 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.6 mmtt -70.06 -29.82 66.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.185 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.421 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.5 mt -90.31 4.52 50.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.563 0.22 . . . . 10.0 111.411 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.907 -0.568 . . . . 10.0 109.866 179.071 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.6 mmm . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 120.869 0.366 . . . . 10.0 110.228 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.44 154.68 18.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.903 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.475 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 24.3 t70 -60.15 -52.8 63.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.124 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.475 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 24.4 mmtm -137.8 106.41 5.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.859 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.0 tp -82.93 137.3 34.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.081 -0.34 . . . . 10.0 110.081 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -73.23 134.52 44.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.279 -0.418 . . . . 10.0 110.889 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -159.83 168.29 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.257 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.509 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.5 tp10 -147.49 135.22 21.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.145 178.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.465 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.7 mt -83.68 106.69 14.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.433 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.448 HG13 ' HB3' ' A' ' 37' ' ' PRO . 37.2 mm -77.11 -56.51 7.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.937 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -157.83 126.79 5.71 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.062 -179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -73.46 142.61 46.85 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.1 mt -110.69 -75.65 0.62 Allowed 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.368 -0.533 . . . . 10.0 111.539 -178.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.635 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.9 mm -131.03 136.95 56.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.162 0.506 . . . . 10.0 111.741 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.542 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.3 p -117.23 123.18 71.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.246 -1.02 . . . . 10.0 108.246 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -90.45 -80.87 0.32 Allowed 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.764 -0.374 . . . . 10.0 111.308 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.3 m 176.59 -179.13 0.17 Allowed 'General case' 0 C--O 1.235 0.34 0 C-N-CA 122.952 0.501 . . . . 10.0 110.006 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 45.1 mp0 -95.09 164.46 12.86 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.02 -167.69 1.25 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.307 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.48 -25.71 68.14 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 10.0 110.556 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -91.56 0.24 57.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.146 -0.933 . . . . 10.0 110.728 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 -1.56 88.57 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.811 -0.709 . . . . 10.0 111.492 -178.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.508 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.0 m0 -53.05 105.64 0.13 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.569 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.0 tpp85 -80.37 100.16 8.3 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 178.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -81.57 112.02 18.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.675 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.542 ' HG2' HG23 ' A' ' 15' ' ' VAL . 54.3 mt-10 -137.98 152.4 48.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.372 0.606 . . . . 10.0 111.58 -179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.78 HD13 ' HB ' ' A' ' 41' ' ' ILE . 34.2 tp -122.99 107.65 12.05 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -134.28 157.76 45.5 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.478 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -97.12 114.32 25.99 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.465 HG12 ' HA ' ' A' ' 9' ' ' ILE . 15.7 m -125.41 162.04 28.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.795 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.509 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -98.78 123.97 43.36 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.95 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -64.28 112.28 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.982 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.42 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.6 m-80 58.72 28.93 17.96 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.681 0.613 . . . . 10.0 110.447 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.7 t70 64.23 27.69 13.91 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.128 -0.942 . . . . 10.0 110.648 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.47 -82.61 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.366 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 31' ' ' SER . 35.7 tt0 -89.19 120.5 69.82 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.556 -178.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.448 ' HB3' HG13 ' A' ' 10' ' ' ILE . 33.8 Cg_endo -82.93 120.64 3.06 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.664 2.243 . . . . 10.0 111.111 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.441 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 16.3 ttpt -148.19 160.73 42.63 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.216 -0.29 . . . . 10.0 110.216 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -81.63 140.0 34.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.628 -0.26 . . . . 10.0 110.692 -178.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.407 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -150.4 133.9 16.49 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.78 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.6 tt -111.86 122.75 66.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.118 0.485 . . . . 10.0 109.92 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.407 ' HG3' ' OD1' ' A' ' 40' ' ' ASP . 3.4 mtt85 -148.14 171.19 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.495 -177.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.569 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.7 p -121.31 134.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -118.76 177.97 4.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.541 0.21 . . . . 10.0 110.872 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.7 m -63.38 151.81 86.59 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.837 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.04 -30.73 83.27 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.528 2.152 . . . . 10.0 111.88 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -91.11 -3.03 57.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.253 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 64.25 24.83 13.44 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.716 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.37 -34.05 61.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.008 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -141.33 174.45 10.53 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.347 0.594 . . . . 10.0 111.722 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.93 172.62 10.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.761 -1.109 . . . . 10.0 110.944 -178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -140.58 -171.71 12.6 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 121.062 -0.59 . . . . 10.0 112.475 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.8 mttp -99.0 144.33 28.28 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 121.979 -0.718 . . . . 10.0 112.446 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.4 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -143.59 -120.38 1.47 Allowed Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.577 -1.009 . . . . 10.0 110.577 178.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -149.18 142.65 18.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 117.513 0.656 . . . . 10.0 110.818 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.2 m -97.47 139.79 32.88 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.973 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.7 mt -115.8 118.77 33.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.913 0.387 . . . . 10.0 110.594 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -77.5 167.28 21.91 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.8 -39.88 86.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.779 0.323 . . . . 10.0 110.399 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.431 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 6.7 pt-20 -56.63 -46.93 80.68 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.253 178.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 31.5 mt-10 -67.81 -56.37 9.42 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.786 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.702 ' CE2' HD11 ' A' ' 66' ' ' LEU . 7.8 t80 -49.72 -47.95 50.29 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.029 0.831 . . . . 10.0 111.776 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.94 -56.46 25.19 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.39 -0.433 . . . . 10.0 113.382 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.1 t -67.28 -42.33 87.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.82 0.343 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 17.5 tp -58.53 -53.38 58.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.016 -178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.719 HD22 ' HB3' ' B' ' 69' ' ' LEU . 21.2 mt -61.26 -44.41 97.28 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.38 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.7 tttm -52.19 -53.49 42.69 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.046 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.619 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 54.5 mm-40 -70.09 -47.88 59.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.702 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.522 ' HB3' HD22 ' B' ' 66' ' ' LEU . 59.0 mt -58.27 -45.46 87.83 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.633 0.234 . . . . 10.0 111.633 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.3 -35.04 91.46 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.565 -0.826 . . . . 10.0 111.396 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -73.48 -28.72 62.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.491 -0.354 . . . . 10.0 110.859 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.619 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 52.1 mmtt -68.88 -23.4 64.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.986 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.588 HD11 ' HB3' ' B' ' 66' ' ' LEU . 27.3 mt -89.86 -14.35 34.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.868 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.851 -0.595 . . . . 10.0 110.462 -179.642 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 31.9 mmm . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.689 0.28 . . . . 10.0 110.605 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.72 161.04 13.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' ASP . . . . . 0.44 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 23.2 t70 -66.79 -52.73 40.54 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' LYS . . . . . 0.44 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 31.6 mmtm -136.98 104.95 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.031 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 37.4 tp -82.18 133.67 35.27 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 179.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.8 tppt? -72.47 133.14 44.69 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.072 0.463 . . . . 10.0 111.282 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -158.35 170.02 23.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.554 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.483 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.0 tp10 -147.32 133.64 19.55 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . 0.532 ' HA ' HG12 ' B' ' 30' ' ' VAL . 50.9 mt -81.63 105.0 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.98 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 47.3 mm -75.34 -56.93 7.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.071 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -157.58 130.33 7.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.981 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.92 141.31 40.56 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.922 -0.77 . . . . 10.0 108.922 178.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 44.0 mt -110.27 -74.09 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.439 -0.504 . . . . 10.0 111.664 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.506 HD12 ' CB ' ' A' ' 68' ' ' GLU . 19.5 mm -130.29 136.79 57.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.046 0.45 . . . . 10.0 111.714 -177.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.468 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -118.48 120.45 64.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -87.43 -81.15 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.719 -0.392 . . . . 10.0 111.41 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m 176.07 -177.99 0.13 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.017 0.527 . . . . 10.0 109.922 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 36.7 mp0 -96.81 163.92 12.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.15 -166.61 1.13 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.461 -0.2 . . . . 10.0 110.461 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.85 -26.76 68.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.388 0.613 . . . . 10.0 110.89 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -92.04 0.41 57.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.322 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.51 -0.23 89.7 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.632 -0.794 . . . . 10.0 111.666 -178.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' TRP . . . . . 0.513 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -52.72 106.28 0.15 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 112.03 0.382 . . . . 10.0 112.03 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.535 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.3 tpp85 -80.59 100.25 8.52 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -81.59 112.19 18.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.755 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.468 ' HG2' HG23 ' B' ' 15' ' ' VAL . 53.8 mt-10 -138.21 152.94 49.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.387 0.613 . . . . 10.0 111.811 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.753 HD13 ' HB ' ' B' ' 41' ' ' ILE . 36.8 tp -123.08 107.56 11.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.008 -1.108 . . . . 10.0 108.008 178.278 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -134.45 157.28 46.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.565 -0.289 . . . . 10.0 110.714 -178.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -96.67 114.97 26.66 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' B' ' 9' ' ' ILE . 19.4 m -126.69 160.99 34.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.665 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -97.28 124.54 41.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.079 0.466 . . . . 10.0 111.094 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -64.46 111.75 2.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.008 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.4 m-80 58.4 30.63 19.9 Favored 'General case' 0 CA--C 1.521 -0.139 0 O-C-N 123.802 0.689 . . . . 10.0 110.361 -178.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.4 t0 61.0 33.01 19.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.986 -1.006 . . . . 10.0 110.565 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.46 -78.72 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.923 -0.58 . . . . 10.0 111.289 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -92.41 117.55 67.68 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.432 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.4 Cg_endo -81.0 119.98 3.67 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.592 2.195 . . . . 10.0 111.279 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ttpt -148.36 161.62 41.2 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.035 -0.266 . . . . 10.0 110.436 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -81.17 139.53 35.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.876 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.412 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -150.71 132.61 15.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' ILE . . . . . 0.753 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.8 tt -110.25 122.87 65.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-O 121.246 0.546 . . . . 10.0 110.193 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.412 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.1 mtt85 -147.88 170.58 17.35 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.661 -177.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.5 p -120.53 134.17 55.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m0 -118.03 177.75 4.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.789 -0.187 . . . . 10.0 110.973 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -66.11 151.04 96.15 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.675 -0.239 . . . . 10.0 110.372 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.61 -33.34 96.81 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.569 2.18 . . . . 10.0 111.793 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -87.15 -5.03 59.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.289 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 66.48 21.0 10.87 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.586 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -70.49 -37.87 74.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.956 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -137.79 174.17 10.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.495 0.664 . . . . 10.0 112.293 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.58 172.09 11.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.743 -1.117 . . . . 10.0 110.72 -178.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -140.14 -170.18 11.92 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 121.034 -0.603 . . . . 10.0 112.248 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -99.7 142.2 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.987 -0.714 . . . . 10.0 112.53 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.406 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -140.01 -120.64 1.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 110.209 -1.156 . . . . 10.0 110.209 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.3 tt -150.06 143.26 17.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.413 0.607 . . . . 10.0 110.565 179.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m -97.0 140.0 32.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.271 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -116.5 117.71 30.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.845 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -76.22 166.67 23.13 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.22 -39.24 85.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 10.0 110.166 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . 0.416 ' HG3' ' N ' ' B' ' 61' ' ' GLU . 7.0 pt-20 -56.88 -44.98 82.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.44 -0.8 . . . . 10.0 110.381 177.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' B' ' 60' ' ' GLU . 33.8 mt-10 -69.63 -56.37 7.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.454 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.552 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.2 t80 -52.25 -44.5 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.82 0.7 . . . . 10.0 111.332 -179.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.81 -55.44 30.85 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.907 -0.663 . . . . 10.0 113.128 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.8 t -68.99 -44.18 81.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.895 0.378 . . . . 10.0 111.228 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.25 -52.45 65.27 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.007 -178.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . 0.588 ' HB3' HD11 ' A' ' 73' ' ' LEU . 29.8 mt -59.03 -50.75 72.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.775 0.322 . . . . 10.0 110.742 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -50.08 -55.33 15.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.934 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . 0.635 ' HB3' HD12 ' A' ' 14' ' ' ILE . 40.6 mm-40 -67.95 -49.67 60.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.983 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.719 ' HB3' HD22 ' A' ' 66' ' ' LEU . 64.7 mt -58.86 -45.4 90.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.613 0.227 . . . . 10.0 111.613 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.64 -36.72 93.65 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.616 -0.802 . . . . 10.0 111.15 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -73.59 -28.02 61.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.938 0.399 . . . . 10.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.4 mmtt -66.81 -25.93 66.69 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.87 0.367 . . . . 10.0 110.689 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.437 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.5 mt -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.313 179.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.77 -0.633 . . . . 10.0 110.205 179.739 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.8 mmm . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 121.001 0.429 . . . . 10.0 110.084 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.06 160.16 25.91 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.383 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -64.16 -49.41 72.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 10.0 110.25 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -134.55 108.32 8.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.098 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.735 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 32.6 tp -82.77 134.7 35.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.095 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -70.31 139.18 52.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.93 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.622 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 13.5 p90 -166.57 175.08 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.488 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -158.51 134.01 8.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.628 ' HA ' HG12 ' A' ' 30' ' ' VAL . 52.2 mt -80.79 111.82 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.9 mm -83.4 -45.96 18.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.591 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -159.31 132.43 7.04 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.107 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.0 127.44 33.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 75.9 mt -99.99 -74.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.474 -0.49 . . . . 10.0 111.931 -178.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.638 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.2 mm -130.09 144.16 38.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.086 0.469 . . . . 10.0 112.212 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.487 HG23 ' HG2' ' A' ' 26' ' ' GLU . 4.3 p -124.48 123.86 67.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.324 -0.991 . . . . 10.0 108.324 177.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.2 mt -91.02 -80.36 0.34 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.366 -0.534 . . . . 10.0 111.046 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 175.51 -177.42 0.11 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.086 0.554 . . . . 10.0 109.782 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.488 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 36.4 mp0 -97.26 164.08 12.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.38 -166.4 1.08 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -29.23 70.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.395 0.617 . . . . 10.0 109.874 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -87.91 -1.84 58.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.21 -0.905 . . . . 10.0 110.309 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.64 0.15 89.23 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.672 -0.775 . . . . 10.0 112.041 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.488 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.6 m0 -52.95 107.07 0.19 Allowed 'General case' 0 C--O 1.233 0.235 0 C-N-CA 122.493 0.317 . . . . 10.0 111.794 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 43' ' ' THR . 14.7 tpp85 -79.97 100.28 8.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -82.59 112.75 19.76 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.751 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG2' HG23 ' A' ' 15' ' ' VAL . 45.6 mt-10 -139.25 161.67 36.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.638 0.733 . . . . 10.0 111.975 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.775 HD13 ' HB ' ' A' ' 41' ' ' ILE . 35.3 tp -130.37 108.07 9.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.569 -1.196 . . . . 10.0 108.521 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -135.62 157.38 47.01 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.832 0.349 . . . . 10.0 110.508 -178.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 29' ' ' ARG . 8.6 ttp180 -97.51 114.66 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.628 HG12 ' HA ' ' A' ' 9' ' ' ILE . 23.9 m -124.69 162.16 27.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.769 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 2.4 p -95.31 122.23 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.925 0.393 . . . . 10.0 110.635 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.1 m0 -63.86 109.46 1.76 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.768 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 60.11 29.55 19.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.931 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 t0 61.63 35.11 17.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.803 -1.09 . . . . 10.0 110.715 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.64 -76.8 0.58 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.01 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -92.48 116.16 66.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 61.3 Cg_endo -81.63 120.6 3.56 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.514 2.143 . . . . 10.0 111.049 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -149.88 159.55 44.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.686 0.279 . . . . 10.0 110.48 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.505 ' HD1' HD11 ' A' ' 13' ' ' LEU . 1.0 OUTLIER -78.68 133.95 37.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.895 -179.347 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -144.43 129.01 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.775 ' HB ' HD13 ' A' ' 27' ' ' LEU . 12.8 tt -106.13 122.44 59.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.289 0.566 . . . . 10.0 110.486 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.589 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.8 mtp85 -149.14 174.27 12.52 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.252 -178.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.565 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.8 p -124.19 138.44 54.41 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.625 -0.879 . . . . 10.0 108.625 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -117.89 176.92 4.98 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 121.081 -0.248 . . . . 10.0 110.987 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -66.13 150.7 96.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.365 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.04 -38.16 96.59 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.91 2.407 . . . . 10.0 112.65 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -88.11 5.7 39.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.893 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 57.86 28.05 15.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.277 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -81.03 -31.91 34.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.451 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -140.71 174.79 10.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 10.0 111.587 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.79 172.59 10.69 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.012 -0.994 . . . . 10.0 110.929 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.644 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -138.35 -170.26 11.81 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.734 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.431 ' HA ' ' NH2' ' A' ' 42' ' ' ARG . 22.4 mttp -103.62 141.77 35.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 10.0 112.301 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.46 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -141.0 -117.46 1.37 Allowed Glycine 0 N--CA 1.453 -0.192 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -152.78 142.12 14.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 117.381 0.591 . . . . 10.0 110.976 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 m -96.77 135.13 39.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.333 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 65.3 mt -115.02 117.44 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -78.58 169.96 17.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.567 -0.288 . . . . 10.0 110.558 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -57.38 -44.86 84.78 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.164 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.457 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 7.4 pt-20 -54.97 -45.04 74.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.854 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.457 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 34.8 mt-10 -69.26 -59.77 2.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.008 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.647 ' CE2' HD11 ' A' ' 66' ' ' LEU . 3.5 t80 -52.32 -42.15 63.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.73 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.68 -59.68 10.33 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.233 -0.508 . . . . 10.0 112.648 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 72.3 t -64.63 -41.28 91.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.99 0.424 . . . . 10.0 110.604 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.528 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.1 tp -57.67 -54.24 49.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.807 -179.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.704 ' HB3' HD11 ' B' ' 73' ' ' LEU . 17.2 mt -62.37 -43.24 99.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.702 -0.226 . . . . 10.0 111.464 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -53.43 -50.77 64.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.196 0.522 . . . . 10.0 110.733 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.625 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 41.8 mm-40 -71.5 -48.82 46.53 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.384 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.8 mt -57.37 -45.45 84.43 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.742 0.275 . . . . 10.0 111.742 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.69 -38.06 95.28 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 111.322 -0.711 . . . . 10.0 111.322 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -73.51 -25.21 60.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.869 0.366 . . . . 10.0 110.758 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.625 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.82 -29.02 68.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.883 0.373 . . . . 10.0 110.685 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.648 HD11 ' HB3' ' B' ' 66' ' ' LEU . 36.9 mt -87.72 3.14 49.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.146 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 C--O 1.252 1.184 0 CA-C-O 118.607 -0.711 . . . . 10.0 109.998 179.495 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mmm . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.916 0.389 . . . . 10.0 110.58 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.44 161.22 16.38 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.487 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.528 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 26.7 t70 -64.13 -50.26 68.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.183 0.516 . . . . 10.0 109.754 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.528 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 40.7 mmtm -135.02 109.88 8.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.672 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.711 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 35.7 tp -83.88 135.82 34.35 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.992 -0.373 . . . . 10.0 109.992 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.405 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.2 tppt? -71.34 137.37 48.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.161 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.692 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 11.8 p90 -164.59 177.25 8.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.256 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -159.88 131.97 6.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.521 ' HA ' HG12 ' B' ' 30' ' ' VAL . 51.4 mt -78.37 108.87 12.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 10.0 110.697 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.3 mm -80.02 -50.23 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.139 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -156.51 130.75 8.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.949 -0.568 . . . . 10.0 111.237 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.08 132.14 35.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.506 HD11 ' HD1' ' B' ' 39' ' ' TYR . 57.4 mt -103.87 -71.42 0.73 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.648 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.562 HD12 ' CB ' ' A' ' 68' ' ' GLU . 19.8 mm -131.8 142.37 43.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.978 0.418 . . . . 10.0 111.946 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.431 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.8 p -124.26 121.51 61.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.277 -1.009 . . . . 10.0 108.277 177.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 37.0 mt -88.24 -80.54 0.27 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.615 -0.434 . . . . 10.0 111.489 -178.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 175.25 -178.01 0.11 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.487 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 35.3 mp0 -97.15 163.76 12.79 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.77 -164.01 0.89 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.921 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.33 -23.57 64.72 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.294 0.568 . . . . 10.0 110.3 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -93.8 -0.35 55.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.937 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.39 0.03 89.36 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.829 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.487 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.5 m0 -53.59 107.62 0.27 Allowed 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.56 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.1 tpp85 -80.46 100.2 8.39 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -81.5 113.19 19.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.857 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.431 ' HG2' HG23 ' B' ' 15' ' ' VAL . 50.5 mt-10 -139.74 162.03 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.519 0.676 . . . . 10.0 112.037 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.757 HD13 ' HB ' ' B' ' 41' ' ' ILE . 32.8 tp -131.76 107.14 8.58 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.725 -1.125 . . . . 10.0 108.517 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -135.5 155.95 49.68 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.634 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -96.18 114.53 26.24 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' B' ' 9' ' ' ILE . 17.0 m -122.91 162.19 23.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.443 -179.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.0 p -94.97 121.96 37.13 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.949 0.404 . . . . 10.0 110.373 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . 0.531 ' CH2' ' H72' ' C' ' 17' ' ' ' DT' . 6.7 m0 -63.63 109.92 1.84 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.661 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.405 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.9 m-80 60.54 28.14 17.81 Favored 'General case' 0 N--CA 1.462 0.14 0 O-C-N 123.781 0.676 . . . . 10.0 110.115 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.0 t70 65.91 25.29 11.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.585 -1.189 . . . . 10.0 110.982 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.74 -78.41 0.58 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.13 -0.356 . . . . 10.0 111.916 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -87.48 117.17 68.2 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.775 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 58.9 Cg_endo -82.82 119.45 2.91 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.143 1.896 . . . . 10.0 110.971 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.455 ' HE3' HG21 ' B' ' 56' ' ' THR . 12.3 ttpt -148.51 158.38 44.08 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 121.01 -0.276 . . . . 10.0 110.471 -178.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . 0.506 ' HD1' HD11 ' B' ' 13' ' ' LEU . 1.2 m-85 -78.6 133.08 37.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.457 -179.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -143.72 129.25 19.09 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.757 ' HB ' HD13 ' B' ' 27' ' ' LEU . 12.1 tt -106.67 122.5 60.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.287 0.565 . . . . 10.0 110.525 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.601 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.2 mtp85 -149.23 175.07 11.71 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.332 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.56 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.4 p -125.17 138.3 54.14 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.8 m-90 -117.88 176.87 5.0 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.921 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.8 m -64.99 150.79 94.76 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.581 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.39 -42.27 69.93 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.788 2.325 . . . . 10.0 112.408 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -88.36 11.75 15.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.117 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 53.48 33.35 15.89 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.563 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -84.02 -32.79 24.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.371 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -141.32 174.31 10.66 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.325 0.584 . . . . 10.0 111.351 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.27 173.05 9.58 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.711 -1.131 . . . . 10.0 110.646 -178.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.614 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -139.72 -169.21 11.56 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.979 -0.629 . . . . 10.0 112.578 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . 0.431 ' HA ' ' NH2' ' B' ' 42' ' ' ARG . 18.3 mttp -102.26 144.59 30.58 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.237 0.541 . . . . 10.0 112.033 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -144.18 -120.25 1.41 Allowed Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 110.73 -0.948 . . . . 10.0 110.73 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -151.65 142.38 15.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 117.309 0.555 . . . . 10.0 110.603 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.455 HG21 ' HE3' ' B' ' 38' ' ' LYS . 2.5 m -96.55 136.09 37.54 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.648 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.83 117.53 30.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.324 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.65 171.18 15.51 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.664 -0.243 . . . . 10.0 110.534 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -58.39 -44.83 89.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.98 0.419 . . . . 10.0 110.323 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.456 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.4 pt-20 -55.13 -45.03 75.58 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.894 178.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.456 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 33.5 mt-10 -70.25 -60.52 2.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.936 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.527 ' CE2' HD11 ' B' ' 66' ' ' LEU . 1.6 t80 -52.83 -38.27 61.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.658 -0.701 . . . . 10.0 111.553 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.96 -57.9 16.41 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.157 -0.544 . . . . 10.0 112.616 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 43.4 t -66.76 -40.07 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.442 . . . . 10.0 110.423 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.0 tp -58.21 -53.18 61.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.604 -0.725 . . . . 10.0 111.03 -179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.648 ' HB3' HD11 ' A' ' 73' ' ' LEU . 55.9 mt -60.3 -49.89 75.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.273 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.7 tttm -50.78 -51.58 49.16 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.464 0.477 . . . . 10.0 111.657 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.638 ' HB3' HD12 ' A' ' 14' ' ' ILE . 21.9 mm-40 -70.41 -49.2 51.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.71 -179.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.604 ' HB3' HD22 ' A' ' 66' ' ' LEU . 60.8 mt -59.81 -42.74 94.15 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.49 -39.4 97.78 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -72.88 -25.44 61.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.065 0.459 . . . . 10.0 111.037 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.6 mmtt -66.44 -29.67 69.86 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.997 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.704 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.1 mt -90.97 5.15 49.89 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.999 -0.28 . . . . 10.0 111.395 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 . . . . . 0 C--O 1.25 1.102 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 178.117 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 C3'-C2'-C1' 101.701 -0.714 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.54 ' H71' ' O ' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C3'-C2'-C1' 101.457 -0.888 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.861 0 O4'-C1'-C2' 104.074 -1.842 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.735 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C4'-C3'-C2' 101.331 -1.869 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.589 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.962 0 O4'-C4'-C3' 103.485 -2.115 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.85 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.434 1.049 0 C5'-C4'-O4' 113.17 2.356 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.889 0 C3'-C2'-C1' 101.18 -1.086 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 C3'-C2'-C1' 101.365 -0.954 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . 0.426 ' H71' ' O ' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 C5'-C4'-C3' 115.717 0.678 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.428 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 O4'-C1'-C2' 104.257 -1.676 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.711 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.791 0 O4'-C4'-C3' 103.604 -1.996 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.601 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.977 0 O4'-C4'-C3' 103.669 -1.931 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.864 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.953 0 C5'-C4'-O4' 113.237 2.398 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.531 ' H72' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.424 -0.973 0 C3'-C2'-C1' 101.049 -1.179 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.971 0.415 . . . . 10.0 110.653 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -111.11 173.22 6.44 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.56 -54.95 8.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -137.41 104.18 5.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.846 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.707 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.8 tp -73.46 145.97 45.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.164 179.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -76.12 131.53 39.47 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.055 0.455 . . . . 10.0 110.583 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.534 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 13.1 p90 -156.16 166.52 33.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.808 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.518 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.5 tp10 -150.95 124.35 8.92 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.505 -0.554 . . . . 10.0 109.505 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.2 mt -75.67 110.23 10.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.031 0.443 . . . . 10.0 110.106 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.5 mm -80.92 -43.34 20.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.43 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -164.22 128.13 2.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.972 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -76.45 135.22 39.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.587 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 95.9 mt -105.93 -74.84 0.64 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.78 -0.368 . . . . 10.0 111.809 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.665 HD12 ' HB3' ' B' ' 68' ' ' GLU . 23.8 mm -132.71 138.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.338 0.59 . . . . 10.0 112.318 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.01 119.8 59.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 107.693 -1.225 . . . . 10.0 107.693 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.491 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.7 mt -88.85 -80.85 0.28 Allowed 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.382 -0.527 . . . . 10.0 111.816 -178.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -175.67 -171.94 0.5 Allowed 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.443 -0.577 . . . . 10.0 109.443 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.7 mp0 -105.47 140.92 37.84 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -79.21 -170.78 2.4 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -26.03 68.27 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.566 0.698 . . . . 10.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HG2' ' C2 ' ' C' ' 1' ' ' ' DT' . 22.9 mttt -91.28 4.55 52.06 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.028 -0.987 . . . . 10.0 110.921 -179.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.22 7.27 87.95 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.454 -0.879 . . . . 10.0 110.98 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -62.14 101.4 0.22 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 10.0 111.416 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.414 ' HG3' ' HG3' ' A' ' 26' ' ' GLU . 16.7 tpp85 -81.48 103.25 11.09 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.932 -0.577 . . . . 10.0 109.671 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -86.5 113.29 22.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.798 0.333 . . . . 10.0 110.153 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.414 ' HG3' ' HG3' ' A' ' 24' ' ' ARG . 61.4 mt-10 -129.93 146.94 51.64 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.353 0.597 . . . . 10.0 111.464 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.587 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 26.3 tp -114.05 108.0 16.42 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.716 -1.216 . . . . 10.0 107.716 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -134.44 152.95 52.11 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.944 0.402 . . . . 10.0 111.27 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -86.67 114.65 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.77 158.3 41.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.941 0.401 . . . . 10.0 110.828 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.518 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.9 p -97.13 125.05 41.36 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.629 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.6 m0 -64.49 108.04 1.54 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.652 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.3 m-80 60.03 29.06 18.66 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 123.776 0.672 . . . . 10.0 110.488 -178.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.4 t70 66.75 18.0 10.64 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.928 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.6 -79.15 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.988 -0.445 . . . . 10.0 111.918 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -97.19 124.92 47.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -178.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.3 Cg_endo -83.85 121.81 2.91 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 123.017 2.478 . . . . 10.0 111.874 178.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.585 ' HD2' HG22 ' A' ' 56' ' ' THR . 13.8 ttmm -143.98 167.24 22.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -88.42 133.54 34.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.503 0.192 . . . . 10.0 110.746 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.499 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -146.89 130.09 16.53 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.467 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.6 tt -104.56 122.9 58.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.532 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.2 mtt85 -142.04 -178.38 5.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -177.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -113.44 142.17 46.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.962 -1.017 . . . . 10.0 112.02 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -123.7 164.3 19.39 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.48 -0.782 . . . . 10.0 109.007 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.2 p -78.37 158.89 76.01 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.27 -20.91 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.431 2.087 . . . . 10.0 112.283 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.28 0.53 25.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.177 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 56.26 37.01 28.43 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.647 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -90.62 -39.73 12.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.274 0.559 . . . . 10.0 109.975 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -134.04 174.64 10.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.344 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.447 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -147.88 172.94 13.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.963 -177.544 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.656 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -128.6 -162.17 10.91 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.319 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -98.9 152.13 20.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.671 . . . . 10.0 111.694 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -140.98 -122.32 1.85 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.326 -0.71 . . . . 10.0 111.326 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.9 tt -151.65 140.84 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.265 0.555 . . . . 10.0 111.154 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.585 HG22 ' HD2' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -99.79 144.3 29.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.17 -179.894 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.84 128.62 47.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.17 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.19 163.9 26.13 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.924 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -55.6 -48.51 74.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.854 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.32 -47.64 83.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 10.0 111.076 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -61.04 -45.39 94.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.67 ' CE2' HD11 ' A' ' 66' ' ' LEU . 26.9 t80 -60.94 -45.19 95.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.268 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.33 -52.22 53.98 Favored Glycine 0 N--CA 1.451 -0.3 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.722 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.4 t -62.25 -42.27 94.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.877 0.37 . . . . 10.0 110.478 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -58.12 -54.4 47.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.794 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.67 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -63.39 -43.09 98.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.15 -0.22 . . . . 10.0 111.578 -179.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.0 tttm -52.78 -51.33 61.13 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 26.0 mm-40 -71.03 -45.32 64.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.599 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.5 mt -59.19 -43.66 92.19 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.664 0.269 . . . . 10.0 111.099 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.68 -38.31 96.22 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.574 -0.822 . . . . 10.0 111.084 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -69.68 -28.76 66.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.996 0.426 . . . . 10.0 110.491 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.9 mmtt -68.71 -30.23 68.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.07 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.492 HD11 ' HB3' ' B' ' 66' ' ' LEU . 41.8 mt -86.17 -11.44 52.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.192 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.562 -0.732 . . . . 10.0 110.835 -179.821 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.751 0.31 . . . . 10.0 110.518 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.52 175.68 5.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.4 -55.08 6.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.046 0.451 . . . . 10.0 109.865 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' B' ' 4' ' ' LYS . 13.3 mmmm -136.54 103.65 5.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.543 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.705 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 25.3 tp -73.12 144.27 47.03 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.098 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.9 tppt? -75.8 128.56 35.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.331 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.613 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 12.9 p90 -153.52 165.84 34.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.119 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.51 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.6 tp10 -150.51 124.49 9.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.58 110.22 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.199 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -80.77 -41.49 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.335 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -164.71 129.23 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.927 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.68 137.89 39.67 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.419 -0.956 . . . . 10.0 108.419 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.564 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 95.1 mt -108.96 -73.15 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.022 -0.671 . . . . 10.0 111.997 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.502 HD12 ' CB ' ' A' ' 68' ' ' GLU . 15.3 mm -131.22 139.45 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.984 0.421 . . . . 10.0 111.848 -177.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.7 117.2 49.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 177.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -85.7 -80.8 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.798 -0.361 . . . . 10.0 111.677 -177.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.1 m -179.21 -171.61 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 50.3 mp0 -103.08 142.77 33.55 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.131 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -81.21 -171.07 3.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.96 -0.563 . . . . 10.0 109.531 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.88 -18.81 65.56 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.368 0.604 . . . . 10.0 110.918 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . 0.407 ' HG2' ' C2 ' ' C' ' 11' ' ' ' DT' . 17.7 mttt -97.84 3.99 49.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.308 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.94 6.28 86.93 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.509 -0.853 . . . . 10.0 111.293 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -62.04 102.53 0.29 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.911 0.386 . . . . 10.0 111.372 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.417 ' HG3' ' HG3' ' B' ' 26' ' ' GLU . 16.4 tpp85 -81.72 102.27 10.63 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.831 178.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.72 113.75 22.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.711 0.291 . . . . 10.0 110.299 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.417 ' HG3' ' HG3' ' B' ' 24' ' ' ARG . 53.0 mt-10 -130.87 147.67 52.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.241 0.543 . . . . 10.0 111.193 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.564 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 28.8 tp -115.22 107.87 15.86 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.908 -1.145 . . . . 10.0 107.908 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -133.72 154.11 51.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.867 0.365 . . . . 10.0 111.047 -177.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -88.05 114.19 24.42 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.361 -0.977 . . . . 10.0 108.361 178.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 16.2 m -127.37 158.1 38.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.791 0.329 . . . . 10.0 110.703 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.51 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.2 p -96.81 124.83 40.9 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.941 0.401 . . . . 10.0 110.565 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -63.97 108.68 1.56 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.574 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.477 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 61.9 m-80 58.66 30.69 20.24 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.369 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 36.0 t70 67.31 14.91 9.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.81 -1.087 . . . . 10.0 111.557 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.35 -81.35 0.47 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.053 0.39 . . . . 10.0 112.053 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -94.45 124.83 54.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.465 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 71.0 Cg_endo -83.14 124.13 3.7 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.743 2.296 . . . . 10.0 112.032 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.42 ' HB2' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -145.92 164.46 31.94 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -87.07 130.77 34.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.337 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.47 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.2 t0 -144.58 131.17 19.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.478 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.8 tt -105.22 123.0 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.601 HH21 H2'' ' C' ' 14' ' ' ' DT' . 2.9 mtp85 -142.33 -178.08 5.57 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.606 0.595 . . . . 10.0 112.606 -177.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.2 p -114.28 143.11 45.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.976 -1.011 . . . . 10.0 112.149 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 54.7 m95 -123.56 166.19 15.86 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.488 -0.778 . . . . 10.0 108.906 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -80.02 159.31 71.11 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.2 -26.1 67.96 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.578 2.186 . . . . 10.0 112.471 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -104.03 0.36 29.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.582 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER 58.84 37.29 24.89 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.577 -0.738 . . . . 10.0 111.766 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -89.87 -38.94 13.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.148 0.499 . . . . 10.0 110.384 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -134.86 174.35 10.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.321 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.453 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -147.01 173.07 12.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.929 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.652 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -128.98 -162.55 10.98 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.142 -0.552 . . . . 10.0 112.277 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -96.95 154.2 17.44 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.013 -0.698 . . . . 10.0 111.708 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.44 -122.62 1.77 Allowed Glycine 0 C--N 1.331 0.264 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.384 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.2 tt -152.53 139.84 13.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 117.276 0.538 . . . . 10.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.23 141.96 31.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.1 mt -124.61 126.24 45.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.157 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -73.81 164.56 26.48 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.385 -0.371 . . . . 10.0 110.149 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -58.4 -44.48 89.0 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.491 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.2 pt-20 -65.54 -43.92 88.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.76 0.314 . . . . 10.0 110.793 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -64.82 -47.64 77.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.385 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.636 ' CE2' HD11 ' B' ' 66' ' ' LEU . 12.5 t80 -59.44 -40.22 86.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.799 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.72 -53.33 46.22 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.595 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.491 ' HB ' HD22 ' A' ' 16' ' ' LEU . 20.1 t -62.05 -42.15 93.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 120.924 0.392 . . . . 10.0 110.261 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.9 tp -58.28 -54.19 49.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.937 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.636 HD11 ' CE2' ' B' ' 62' ' ' PHE . 45.9 mt -61.17 -48.72 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.08 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -50.15 -53.86 24.71 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.75 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.665 ' HB3' HD12 ' A' ' 14' ' ' ILE . 24.3 mm-40 -69.22 -45.69 69.22 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.872 -178.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.473 HD13 ' CD2' ' A' ' 66' ' ' LEU . 70.8 mt -61.09 -42.34 98.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.612 0.244 . . . . 10.0 111.279 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.98 -38.13 96.09 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.673 -0.971 . . . . 10.0 110.673 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -70.09 -30.54 67.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.294 -0.453 . . . . 10.0 110.508 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.9 mmtt -65.65 -31.31 72.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.559 -0.291 . . . . 10.0 111.35 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.522 HD11 ' CB ' ' A' ' 66' ' ' LEU . 29.4 mt -90.36 -3.07 57.96 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.45 -0.786 . . . . 10.0 109.926 179.664 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . 0.434 ' C2 ' ' HG2' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 O5'-C5'-C4' 109.017 -0.845 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 101.335 -0.975 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -0.968 0 O4'-C1'-C2' 104.081 -1.835 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.709 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C4'-C3' 103.549 -2.051 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 O4'-C4'-C3' 103.41 -2.19 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.913 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.928 0 C5'-C4'-O4' 113.1 2.313 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.938 0 C3'-C2'-C1' 101.12 -1.128 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . 0.407 ' C2 ' ' HG2' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 101.038 -1.187 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.944 0 C5'-C4'-C3' 115.756 0.704 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.942 0 O4'-C1'-C2' 104.458 -1.493 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.705 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 O4'-C4'-C3' 103.483 -2.117 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 O4'-C4'-C3' 103.903 -1.697 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.878 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.825 0 C5'-C4'-O4' 113.213 2.383 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 101.051 -1.178 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 mmt . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.819 0.343 . . . . 10.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -93.01 169.46 10.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.698 -0.482 . . . . 10.0 109.698 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.99 -47.4 71.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.081 0.467 . . . . 10.0 110.005 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -137.51 113.92 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.148 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.72 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 24.5 tp -85.1 143.15 29.03 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -78.35 131.67 37.09 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.021 0.439 . . . . 10.0 110.376 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.526 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 12.9 p90 -152.14 171.57 17.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.798 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.543 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.2 tp10 -152.23 121.66 6.82 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.799 -0.445 . . . . 10.0 109.799 179.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.598 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.2 mt -79.37 105.7 9.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.904 0.383 . . . . 10.0 110.578 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.36 -51.96 19.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.184 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -162.72 130.54 3.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.141 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.92 144.17 41.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.664 -0.495 . . . . 10.0 109.664 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.493 ' O ' HD13 ' A' ' 14' ' ' ILE . 71.9 mt -109.28 -75.17 0.63 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.783 -0.367 . . . . 10.0 111.915 -178.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.76 HD12 ' HB3' ' B' ' 68' ' ' GLU . 32.1 mm -128.7 141.69 45.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -177.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.5 p -125.13 123.33 65.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.489 HD22 ' HB ' ' B' ' 64' ' ' VAL . 35.2 mt -92.24 -79.85 0.38 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.544 -0.462 . . . . 10.0 111.276 -178.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.09 -167.33 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.502 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.7 mp0 -108.53 145.38 34.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.769 0.318 . . . . 10.0 110.516 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -82.28 -173.46 4.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.31 -22.34 66.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.397 0.618 . . . . 10.0 110.509 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -88.62 -1.64 58.17 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.279 -0.873 . . . . 10.0 110.84 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 3.47 81.93 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.611 -0.804 . . . . 10.0 111.294 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.502 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.32 105.5 0.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.693 0.282 . . . . 10.0 111.355 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.4 tpp85 -85.47 100.31 11.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.458 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.2 mttt -82.45 115.84 21.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.617 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG2' HG23 ' A' ' 15' ' ' VAL . 83.5 mt-10 -134.68 147.31 50.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.792 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.61 HD13 ' HB ' ' A' ' 41' ' ' ILE . 35.9 tp -116.88 111.76 20.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.43 -0.805 . . . . 10.0 108.956 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -131.54 163.69 27.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 10.0 111.556 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -98.57 113.75 25.91 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.598 HG12 ' HA ' ' A' ' 9' ' ' ILE . 15.1 m -131.21 159.2 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.007 0.432 . . . . 10.0 111.269 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -96.65 125.14 40.91 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.145 178.821 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.1 m0 -63.81 108.99 1.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.525 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 58.21 31.93 21.4 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.481 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.8 t70 66.68 23.4 10.24 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 114.981 -1.009 . . . . 10.0 111.2 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.62 -88.27 0.46 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.102 -0.374 . . . . 10.0 111.745 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -95.57 124.88 51.51 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.547 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 59.6 Cg_endo -77.57 128.46 9.5 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.814 2.342 . . . . 10.0 111.851 178.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -147.94 170.06 18.52 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -94.98 131.21 41.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.213 -0.291 . . . . 10.0 110.213 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -142.42 132.01 23.91 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.61 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.5 tt -108.09 123.46 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.272 0.558 . . . . 10.0 110.059 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.528 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.4 mtt85 -145.79 177.41 8.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.133 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -124.64 142.55 51.3 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.458 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 28.7 m95 -117.56 171.14 8.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -65.55 156.92 80.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.23 -31.15 75.03 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.607 2.204 . . . . 10.0 112.618 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -97.28 2.79 51.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.178 0.513 . . . . 10.0 110.578 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 59.06 26.81 15.58 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.926 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -78.1 -37.07 47.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.116 0.484 . . . . 10.0 110.824 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -133.57 175.01 9.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.923 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.477 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -138.78 172.55 12.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.366 -0.834 . . . . 10.0 111.104 -177.088 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.735 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.85 -163.05 9.36 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.177 -0.535 . . . . 10.0 112.116 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -94.89 155.38 16.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.949 -0.736 . . . . 10.0 112.322 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.444 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.3 -127.05 1.43 Allowed Glycine 0 CA--C 1.518 0.245 0 N-CA-C 110.686 -0.966 . . . . 10.0 110.686 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -148.89 142.63 18.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 117.606 0.703 . . . . 10.0 111.198 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.47 141.15 34.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.839 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -122.09 129.4 52.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.962 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.1 m -74.23 164.97 25.96 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.013 -0.366 . . . . 10.0 110.013 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.47 -46.68 89.04 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.646 0.239 . . . . 10.0 111.646 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -61.96 -40.8 96.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 10.0 110.488 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.482 ' HB3' HD13 ' B' ' 16' ' ' LEU . 87.5 mt-10 -64.33 -49.79 70.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.357 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.761 ' CE2' HD11 ' A' ' 66' ' ' LEU . 15.1 t80 -57.86 -44.84 86.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.276 -0.874 . . . . 10.0 111.314 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.91 -52.16 53.88 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.284 -0.484 . . . . 10.0 112.477 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.426 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 93.0 t -63.34 -45.06 99.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 110.332 -0.247 . . . . 10.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.464 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 24.1 tp -56.19 -52.15 65.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.761 HD11 ' CE2' ' A' ' 62' ' ' PHE . 20.9 mt -62.54 -44.91 95.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.417 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.1 tttm -53.1 -52.02 59.97 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 123.567 0.542 . . . . 10.0 110.818 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 44.8 mm-40 -66.54 -51.99 50.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.428 -0.806 . . . . 10.0 111.212 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 74.2 mt -56.12 -48.32 76.43 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.184 0.439 . . . . 10.0 112.184 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.28 -39.05 96.66 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.344 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -71.23 -20.72 62.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.032 0.444 . . . . 10.0 111.117 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.691 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.7 mmtt -77.41 -26.68 51.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.601 -0.272 . . . . 10.0 110.796 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.528 HD11 ' HB3' ' B' ' 66' ' ' LEU . 24.5 mt -82.96 -19.2 37.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.996 -0.281 . . . . 10.0 111.297 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.385 -0.817 . . . . 10.0 110.887 -179.605 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.2 mmt . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.712 0.291 . . . . 10.0 110.336 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.53 168.52 11.2 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.424 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 28.9 t70 -68.85 -46.7 67.82 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.424 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 39.5 mmtm -137.19 107.7 6.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.176 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.769 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 31.1 tp -79.89 141.07 36.45 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.7 tppt? -77.35 130.17 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.249 0.547 . . . . 10.0 110.738 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.625 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 12.5 p90 -150.94 173.36 14.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.699 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.55 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.4 tp10 -154.72 122.79 5.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.617 ' HA ' HG12 ' B' ' 30' ' ' VAL . 52.9 mt -78.77 108.88 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.133 0.492 . . . . 10.0 110.784 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -78.87 -47.64 22.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.039 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -167.59 130.55 1.66 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.112 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -75.22 145.77 41.72 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 81.2 mt -112.0 -74.66 0.63 Allowed 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.477 -0.489 . . . . 10.0 111.902 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.628 HD12 ' CB ' ' A' ' 68' ' ' GLU . 16.0 mm -127.24 140.8 48.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.025 0.44 . . . . 10.0 111.903 -177.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.413 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -125.93 122.48 62.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.078 -1.082 . . . . 10.0 108.078 177.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' A' ' 61' ' ' GLU . 28.8 mt -92.06 -81.29 0.34 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.373 -0.531 . . . . 10.0 111.778 -178.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -179.18 -167.71 0.11 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.484 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.15 147.55 31.12 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.348 -0.242 . . . . 10.0 110.348 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -85.15 -172.15 4.02 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.34 -20.82 66.19 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.472 0.654 . . . . 10.0 110.464 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -90.21 -2.55 58.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.177 -0.92 . . . . 10.0 110.323 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 4.52 80.85 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.484 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.7 m0 -62.33 105.99 0.69 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.748 0.308 . . . . 10.0 111.333 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.483 ' O ' ' HA ' ' B' ' 43' ' ' THR . 12.3 tpp85 -85.21 100.31 11.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.593 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.508 ' HG2' HG22 ' B' ' 43' ' ' THR . 93.9 mttt -82.06 115.73 21.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.735 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.413 ' HG2' HG23 ' B' ' 15' ' ' VAL . 90.6 mt-10 -134.23 146.61 50.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.859 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.56 HD13 ' HB ' ' B' ' 41' ' ' ILE . 42.7 tp -115.92 111.86 21.03 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.668 -0.864 . . . . 10.0 108.668 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -132.34 162.29 31.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.126 0.488 . . . . 10.0 111.623 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.1 ttm180 -97.7 113.91 25.77 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.617 HG12 ' HA ' ' B' ' 9' ' ' ILE . 22.8 m -131.55 157.12 43.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.904 0.383 . . . . 10.0 111.297 -178.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.55 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -94.19 125.3 38.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.194 178.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -63.88 109.2 1.68 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.543 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.5 m-80 58.5 32.91 22.65 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.831 0.707 . . . . 10.0 110.368 -178.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 67.63 17.79 9.9 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.946 -1.025 . . . . 10.0 111.414 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.04 -89.77 0.38 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.13 0.419 . . . . 10.0 112.13 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -90.96 123.32 65.06 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 112.271 0.471 . . . . 10.0 112.271 -177.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.541 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.87 126.75 8.98 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.831 2.354 . . . . 10.0 111.701 178.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -147.07 170.78 16.43 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -96.94 129.22 44.43 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.325 -0.25 . . . . 10.0 110.325 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.419 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.56 132.25 28.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.279 -0.638 . . . . 10.0 109.279 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.56 ' HB ' HD13 ' B' ' 27' ' ' LEU . 13.2 tt -106.82 122.7 61.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.324 0.583 . . . . 10.0 110.16 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.616 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.0 mtt85 -145.6 176.8 9.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.002 -0.544 . . . . 10.0 111.257 -178.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.508 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -123.85 142.92 50.68 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.332 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 m95 -117.15 173.37 6.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.103 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.0 m -67.87 157.79 85.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -55.44 -31.44 77.87 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.504 2.136 . . . . 10.0 112.48 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -99.3 6.08 46.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.464 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.48 28.39 15.42 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.102 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.58 -38.45 40.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.725 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -133.41 174.23 10.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.112 0.482 . . . . 10.0 111.128 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.411 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -136.4 172.22 13.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.165 -0.925 . . . . 10.0 111.199 -177.337 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.699 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.88 -161.25 8.67 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.984 -0.627 . . . . 10.0 111.797 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -97.79 153.16 18.47 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 122.17 -0.606 . . . . 10.0 112.485 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.61 -124.26 1.46 Allowed Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.403 -1.079 . . . . 10.0 110.403 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.7 tt -153.16 143.25 14.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 117.549 0.675 . . . . 10.0 111.219 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.5 143.78 31.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.383 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 63.7 mt -123.19 129.08 50.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.08 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.0 m -74.59 163.09 28.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.79 -44.86 93.74 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 -178.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.485 ' O ' HG23 ' B' ' 64' ' ' VAL . 10.1 pt-20 -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.133 0.492 . . . . 10.0 110.465 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.143 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.532 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -58.01 -41.36 82.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.544 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.53 -52.84 50.52 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.06 -0.59 . . . . 10.0 112.059 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.489 ' HB ' HD22 ' A' ' 16' ' ' LEU . 28.0 t -63.96 -45.0 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 10.0 110.139 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.8 tp -55.72 -51.43 67.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.012 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 65.4 mt -61.19 -48.92 79.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.976 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 46.6 tttm -52.58 -52.54 54.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.549 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.76 ' HB3' HD12 ' A' ' 14' ' ' ILE . 51.2 mm-40 -65.94 -53.18 42.47 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.558 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.538 ' HB3' HD22 ' A' ' 66' ' ' LEU . 61.3 mt -57.96 -44.06 86.8 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.158 0.429 . . . . 10.0 112.158 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.2 -41.04 99.36 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 111.191 -0.764 . . . . 10.0 111.191 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -72.24 -22.5 61.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.314 -0.443 . . . . 10.0 111.565 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.634 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.6 mmtt -72.41 -26.55 61.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.576 HD11 ' CB ' ' A' ' 66' ' ' LEU . 22.5 mt -88.3 -5.88 58.08 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.151 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.453 -0.784 . . . . 10.0 109.884 179.716 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.434 -0.387 0 C3'-C2'-C1' 101.814 -0.633 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.457 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 C3'-C2'-C1' 101.519 -0.843 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . 0.477 " H1'" ' O ' ' A' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.407 -1.007 0 O4'-C1'-C2' 104.05 -1.864 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.735 " H1'" ' O ' ' A' ' 52' ' ' GLY . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 O4'-C4'-C3' 103.464 -2.136 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.431 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 O4'-C4'-C3' 103.523 -2.077 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.837 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.885 0 C5'-C4'-O4' 113.078 2.299 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 101.141 -1.113 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 C3'-C2'-C1' 101.64 -0.757 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 101.892 -0.577 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.421 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 O4'-C1'-C2' 104.393 -1.551 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.769 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C4'-C3' 103.455 -2.145 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.406 ' C6 ' HD21 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 O4'-C4'-C3' 103.737 -1.863 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.851 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.434 1.046 0 C5'-C4'-O4' 112.916 2.198 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.988 0 C3'-C2'-C1' 101.06 -1.171 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.223 0 CA-C-O 120.69 0.281 . . . . 10.0 110.619 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.12 164.32 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.148 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.6 -48.05 42.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.225 0.536 . . . . 10.0 109.762 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.414 ' HA ' ' HD2' ' A' ' 4' ' ' LYS . 12.8 mmmm -139.48 95.19 2.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.305 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.77 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 22.4 tp -68.93 146.33 52.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.439 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 35.3 tptt -79.37 134.83 36.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.652 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.4 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 6.8 p90 -161.87 166.73 25.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.222 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.494 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -151.8 133.07 14.49 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.635 -0.505 . . . . 10.0 109.635 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.421 ' HA ' HG12 ' A' ' 30' ' ' VAL . 72.4 mt -79.85 111.24 16.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.601 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -82.12 -45.81 19.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.056 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -164.73 127.5 2.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.839 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -80.05 142.07 35.27 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.486 ' O ' HD13 ' A' ' 14' ' ' ILE . 48.5 mt -112.12 -73.74 0.66 Allowed 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.409 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.686 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.0 mm -130.23 138.2 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.71 118.3 56.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 107.403 -1.332 . . . . 10.0 107.403 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.467 HD22 ' HB ' ' B' ' 64' ' ' VAL . 28.1 mt -85.81 -82.12 0.2 Allowed 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.138 -0.625 . . . . 10.0 111.808 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.2 m -174.97 -166.34 0.23 Allowed 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.538 -0.541 . . . . 10.0 109.538 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.4 mp0 -109.78 143.15 40.01 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.89 -0.411 . . . . 10.0 109.89 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -81.69 -171.82 3.54 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.79 -27.93 69.52 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.492 0.663 . . . . 10.0 110.391 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -87.55 3.2 48.43 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.031 -0.986 . . . . 10.0 111.0 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.11 6.27 88.32 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.545 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.434 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -61.9 103.71 0.38 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 10.0 111.416 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.9 tpp85 -81.26 99.53 8.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.185 178.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.486 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.0 mttt -83.96 121.04 26.84 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.957 0.408 . . . . 10.0 110.762 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -136.12 153.34 51.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.944 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.51 HD13 ' HB ' ' A' ' 41' ' ' ILE . 42.6 tp -123.02 106.96 11.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.918 . . . . 10.0 108.646 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -136.58 156.49 48.5 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.176 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -95.69 114.58 26.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.421 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.4 m -121.86 161.97 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.469 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.494 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -94.39 123.86 38.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.01 0.433 . . . . 10.0 110.43 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.97 108.41 1.49 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.619 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.441 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.7 m-80 60.81 27.4 17.2 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.003 -178.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.6 t70 68.62 19.57 8.57 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.938 -1.028 . . . . 10.0 110.914 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.92 -80.09 0.57 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.97 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.68 118.76 69.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -178.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.9 Cg_endo -77.95 120.3 5.0 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.621 2.214 . . . . 10.0 110.711 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.719 ' HE3' HG21 ' A' ' 56' ' ' THR . 17.3 ttpt -145.8 162.97 36.44 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.867 -0.333 . . . . 10.0 110.788 -177.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -86.57 128.32 34.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.558 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.424 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -143.03 131.46 22.24 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.51 ' HB ' HD13 ' A' ' 27' ' ' LEU . 17.9 tt -107.2 123.29 62.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.178 0.513 . . . . 10.0 110.099 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.647 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.1 mtt85 -145.32 177.6 8.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.458 -178.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.486 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -124.96 143.95 50.62 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.726 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 m95 -117.71 173.8 6.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.142 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 p -76.64 156.18 83.07 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.23 -27.62 85.49 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.726 2.284 . . . . 10.0 112.715 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -97.37 -4.58 38.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.651 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.29 34.01 16.17 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.45 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -83.93 -39.36 19.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.762 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -140.56 173.74 11.2 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.21 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.434 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -135.55 172.78 12.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.943 -177.931 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.689 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -137.32 -164.88 10.22 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 121.001 -0.619 . . . . 10.0 112.499 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.5 mttp -95.01 151.92 18.76 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.113 -0.639 . . . . 10.0 112.375 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.78 -128.43 1.89 Allowed Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.277 -0.874 . . . . 10.0 111.479 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 tt -147.34 145.82 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 CA-C-N 117.727 0.764 . . . . 10.0 111.233 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.719 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.2 m -104.96 144.4 31.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.382 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.8 mt -122.43 135.16 54.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.771 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.4 m -77.46 164.51 25.37 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.127 -0.324 . . . . 10.0 110.127 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -59.39 -48.63 80.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.663 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.25 -43.57 97.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.965 0.412 . . . . 10.0 110.804 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -59.14 -48.89 79.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.246 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.651 ' CE2' HD11 ' A' ' 66' ' ' LEU . 33.5 t80 -58.06 -42.15 84.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.006 -0.997 . . . . 10.0 111.167 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.75 34.4 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.277 -0.487 . . . . 10.0 112.489 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 71.5 t -60.38 -43.7 94.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-O 120.969 0.414 . . . . 10.0 110.165 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.465 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -56.48 -52.85 63.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.542 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.691 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.5 mt -62.12 -45.67 92.43 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -52.37 -52.42 53.64 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.431 0.457 . . . . 10.0 111.19 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.576 ' CB ' HD12 ' B' ' 14' ' ' ILE . 52.1 mm-40 -68.69 -48.39 64.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.433 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 65.2 mt -58.97 -45.09 91.41 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.672 0.249 . . . . 10.0 111.672 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.76 -37.18 94.32 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.688 -0.767 . . . . 10.0 111.575 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -71.92 -30.06 64.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.82 0.343 . . . . 10.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 44.9 mmtt -64.63 -27.91 69.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.01 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' B' ' 66' ' ' LEU . 23.3 mt -88.75 -2.13 58.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 10.0 111.78 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.651 -179.592 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.801 0.334 . . . . 10.0 110.667 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.78 167.22 10.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.598 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -76.39 -47.94 21.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -139.46 99.2 3.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.231 -0.895 . . . . 10.0 110.102 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.748 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 26.5 tp -72.88 142.04 47.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.12 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.424 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 10.3 tppt? -77.15 134.39 38.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.948 0.404 . . . . 10.0 110.215 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.571 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 7.9 p90 -160.81 165.17 30.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.897 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.462 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.3 tp10 -149.24 131.96 15.95 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.401 ' HA ' HG12 ' B' ' 30' ' ' VAL . 61.2 mt -77.39 112.95 15.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.08 0.467 . . . . 10.0 110.147 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 44.0 mm -84.45 -42.8 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.096 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -168.35 127.99 1.22 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.644 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -81.41 140.13 34.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 55.7 mt -111.36 -67.19 1.01 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.496 -0.482 . . . . 10.0 112.244 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.576 HD12 ' CB ' ' A' ' 68' ' ' GLU . 12.0 mm -133.97 136.51 53.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 10.0 111.86 -177.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 p -120.74 120.04 61.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.233 -1.395 . . . . 10.0 107.233 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -87.04 -81.86 0.22 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.369 -0.532 . . . . 10.0 111.967 -177.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 5.4 m -177.26 -167.75 0.17 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.117 -0.697 . . . . 10.0 109.117 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.411 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 4.3 mp0 -107.07 143.48 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -82.79 -172.63 4.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.06 -25.38 68.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.31 0.576 . . . . 10.0 110.817 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -90.1 2.04 55.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.493 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.1 6.96 84.12 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.493 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.411 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.4 m0 -62.64 103.54 0.43 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.605 0.24 . . . . 10.0 111.613 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -80.35 99.98 8.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.514 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.3 mttt -84.23 119.81 25.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 10.0 110.754 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -135.5 151.59 50.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.991 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.489 HD13 ' HB ' ' B' ' 41' ' ' ILE . 39.2 tp -121.62 107.24 12.15 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -136.63 155.5 49.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.283 -178.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -94.81 115.0 26.96 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.8 m -122.26 161.68 22.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.46 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.462 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.4 p -94.34 123.49 37.78 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.273 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -63.53 109.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.448 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.424 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.4 m-80 59.06 30.9 20.82 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 123.734 0.646 . . . . 10.0 109.785 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 63.94 26.27 14.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.924 -1.035 . . . . 10.0 111.159 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.24 -78.17 0.58 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.729 -0.388 . . . . 10.0 111.755 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -88.75 117.02 67.88 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.413 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 47.9 Cg_endo -77.93 120.06 4.93 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.292 1.995 . . . . 10.0 110.481 178.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.693 ' HE3' HG21 ' B' ' 56' ' ' THR . 16.8 ttpt -146.08 164.0 33.51 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.895 -0.322 . . . . 10.0 110.442 -178.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -88.11 128.45 35.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.505 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -142.94 131.91 22.94 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.379 -0.601 . . . . 10.0 109.379 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.489 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.1 tt -107.03 123.22 62.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 121.514 0.673 . . . . 10.0 110.289 -179.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.643 HH21 H2'' ' C' ' 14' ' ' ' DT' . 4.1 mtt85 -145.54 177.55 8.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.394 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.514 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.47 144.49 50.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.854 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 42.0 m95 -118.06 174.03 6.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.312 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -77.3 156.65 81.38 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -30.01 87.3 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.652 2.234 . . . . 10.0 112.704 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -98.16 -2.94 38.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.934 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.03 31.38 13.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.545 -179.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -79.63 -39.18 32.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.967 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.19 174.05 10.96 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.36 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.406 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -136.02 172.99 12.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 10.0 110.927 -178.147 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.679 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -136.47 -163.08 9.71 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.113 -0.565 . . . . 10.0 112.273 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -97.4 149.01 22.6 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.033 -0.686 . . . . 10.0 112.33 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.405 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -141.45 -129.11 2.43 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.342 -0.845 . . . . 10.0 111.003 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -147.82 146.68 17.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.343 0.572 . . . . 10.0 110.397 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.693 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.1 m -104.38 145.36 30.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.58 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.5 mt -123.09 133.72 54.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.691 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -76.58 164.25 26.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.11 -46.92 88.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.829 0.307 . . . . 10.0 111.829 -178.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.517 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.0 pt-20 -65.46 -41.57 93.25 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -61.15 -49.25 77.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.156 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.96 -39.02 80.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.629 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.18 -52.24 53.17 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.934 -0.65 . . . . 10.0 112.287 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 60' ' ' GLU . 12.1 t -63.37 -44.71 99.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 10.0 110.05 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 15.7 tp -54.87 -52.36 63.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.816 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 73' ' ' LEU . 77.9 mt -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.989 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -49.89 -53.93 22.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.642 -0.708 . . . . 10.0 111.871 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.686 ' HB3' HD12 ' A' ' 14' ' ' ILE . 13.8 mm-40 -68.84 -47.89 64.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.97 -0.559 . . . . 10.0 112.093 -178.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.691 ' HB3' HD22 ' A' ' 66' ' ' LEU . 69.0 mt -61.65 -43.53 98.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.746 0.308 . . . . 10.0 111.696 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -35.65 92.34 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.517 -0.633 . . . . 10.0 111.517 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . 0.435 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 21.1 t-20 -74.55 -27.63 60.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 10.0 110.872 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.5 mmtt -65.55 -29.04 69.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.837 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.0 mt -90.71 6.64 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.965 -0.294 . . . . 10.0 111.655 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.435 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.2 mt-10 . . . . . 0 C--O 1.245 0.829 0 CA-C-O 118.197 -0.906 . . . . 10.0 110.525 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 C3'-C2'-C1' 101.666 -0.738 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 C5'-C4'-C3' 115.887 0.792 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -0.971 0 O4'-C1'-C2' 104.233 -1.697 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.77 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O4'--C1' 1.429 0.687 0 O4'-C4'-C3' 103.459 -2.141 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.544 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.887 0 O4'-C4'-C3' 103.461 -2.139 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.893 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.934 0 C5'-C4'-O4' 113.078 2.299 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C3'-C2'-C1' 101.153 -1.105 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 C3'-C2'-C1' 101.386 -0.938 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.909 0 C3'-C2'-C1' 101.629 -0.765 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 O4'-C1'-C2' 104.37 -1.573 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.748 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C4'-C3' 103.574 -2.026 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.67 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 O4'-C4'-C3' 103.771 -1.829 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.856 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.819 0 C5'-C4'-O4' 113.144 2.34 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.862 0 C3'-C2'-C1' 101.258 -1.03 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.15 155.44 17.74 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.58 -55.29 24.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 10.0 109.815 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -132.35 93.89 3.34 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.335 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.644 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 20.2 tp -65.81 150.79 48.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.355 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 15.4 tppt? -77.63 133.25 38.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.636 0.255 . . . . 10.0 110.455 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -159.14 167.95 27.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.535 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.1 tp10 -154.11 129.48 9.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.401 ' HA ' HG12 ' A' ' 30' ' ' VAL . 49.1 mt -79.13 112.58 17.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.142 0.496 . . . . 10.0 110.704 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -79.42 -40.18 21.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.653 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -169.02 141.91 2.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.247 -0.888 . . . . 10.0 110.347 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.89 135.95 33.17 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.615 -0.883 . . . . 10.0 108.615 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 91.2 mt -104.24 -75.29 0.62 Allowed 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.573 -0.451 . . . . 10.0 111.375 -179.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.714 HD12 ' HB3' ' B' ' 68' ' ' GLU . 32.6 mm -131.68 139.22 51.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 10.0 112.074 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.9 p -122.63 125.79 73.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 107.622 -1.251 . . . . 10.0 107.622 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.481 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -93.89 -81.05 0.38 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.214 -0.595 . . . . 10.0 111.813 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.5 m -177.76 -169.78 0.23 Allowed 'General case' 0 C--O 1.237 0.4 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 -179.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.0 mp0 -104.27 140.62 37.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.374 . . . . 10.0 110.001 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -80.61 -172.0 3.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.61 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.2 -26.47 68.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.716 0.77 . . . . 10.0 110.855 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -91.65 3.93 53.89 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.736 -1.12 . . . . 10.0 111.243 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.23 5.89 89.25 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.518 -0.849 . . . . 10.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -62.95 104.05 0.51 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.928 0.394 . . . . 10.0 110.919 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.498 ' O ' ' HA ' ' A' ' 43' ' ' THR . 10.5 tpp85 -81.69 99.74 9.08 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.668 -0.696 . . . . 10.0 109.473 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.3 mttt -82.43 117.28 22.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.947 0.403 . . . . 10.0 110.713 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -131.53 148.88 52.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.165 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.558 HD13 ' HB ' ' A' ' 41' ' ' ILE . 43.2 tp -119.06 107.77 13.91 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 178.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -135.11 163.03 30.83 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.931 0.396 . . . . 10.0 110.746 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -98.66 114.85 27.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 9' ' ' ILE . 18.9 m -125.64 157.87 34.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 10.0 111.01 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.535 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 3.3 p -94.71 123.64 38.27 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.098 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -64.25 110.04 2.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.638 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.8 m-80 60.53 29.38 18.97 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 123.796 0.685 . . . . 10.0 110.452 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 61.83 34.37 17.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 114.692 -1.14 . . . . 10.0 110.594 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.5 -77.43 0.59 Allowed 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 111.26 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -88.66 115.24 62.89 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.667 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.1 Cg_endo -78.26 121.01 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.517 2.145 . . . . 10.0 111.292 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.486 ' NZ ' " H2'" ' C' ' 7' ' ' ' DT' . 17.0 ttpt -149.73 163.38 38.11 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.948 -0.301 . . . . 10.0 110.698 -178.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -85.51 135.29 33.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -148.84 132.1 16.47 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.558 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.9 tt -107.21 122.11 60.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.325 0.583 . . . . 10.0 109.945 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.483 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.4 mtt85 -143.83 179.36 7.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.209 -177.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.498 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -125.9 145.18 50.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.027 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.5 m95 -117.48 173.85 6.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.214 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.5 p -78.76 159.34 74.14 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -59.47 -27.22 84.41 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.354 2.036 . . . . 10.0 112.422 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -96.11 -0.86 49.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.249 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 55.7 34.89 24.23 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.752 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -92.55 -39.8 11.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.753 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -131.58 174.29 10.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.693 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.424 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -153.4 173.1 16.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.032 -177.674 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.65 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -132.77 -159.56 9.25 Favored Glycine 0 C--O 1.226 -0.38 0 C-N-CA 120.941 -0.647 . . . . 10.0 111.977 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -93.65 161.33 14.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.272 0.536 . . . . 10.0 112.3 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.96 -127.28 1.3 Allowed Glycine 0 CA--C 1.519 0.333 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.974 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -147.88 143.27 19.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 117.838 0.819 . . . . 10.0 111.269 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.47 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.1 m -100.85 145.92 27.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.231 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.1 mt -125.41 127.1 46.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.849 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -76.37 163.02 27.4 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.008 -0.367 . . . . 10.0 110.008 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -55.9 -50.67 70.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.934 0.346 . . . . 10.0 111.934 -178.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -61.61 -46.37 90.13 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.789 0.328 . . . . 10.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -60.27 -47.82 84.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.114 0.483 . . . . 10.0 110.476 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.666 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.2 t80 -59.43 -46.82 87.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.282 -0.872 . . . . 10.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.75 -53.29 46.4 Favored Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 116.178 -0.464 . . . . 10.0 112.578 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.492 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 88.6 t -61.21 -45.55 98.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.674 0.273 . . . . 10.0 110.28 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.55 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 23.2 tp -54.66 -53.05 59.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.669 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.666 HD11 ' CE2' ' A' ' 62' ' ' PHE . 18.4 mt -62.62 -44.45 96.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.323 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -51.98 -50.35 61.45 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.063 0.459 . . . . 10.0 110.943 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.612 ' CB ' HD12 ' B' ' 14' ' ' ILE . 56.7 mm-40 -68.13 -49.53 60.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.146 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 91.1 mt -58.27 -43.86 88.16 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.662 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.09 96.5 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.335 -0.706 . . . . 10.0 111.335 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -73.08 -28.59 62.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.625 0.25 . . . . 10.0 110.72 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 70.1 mmtt -66.67 -28.0 68.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.644 -0.253 . . . . 10.0 111.467 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' B' ' 66' ' ' LEU . 23.1 mt -85.8 -16.24 39.41 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.096 -0.242 . . . . 10.0 111.54 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.486 -0.769 . . . . 10.0 110.715 -179.194 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 120.796 0.332 . . . . 10.0 110.169 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.41 154.55 18.97 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.04 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.431 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 19.0 t70 -62.53 -56.07 21.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.361 0.601 . . . . 10.0 109.711 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 13.3 mmmm -131.96 95.01 3.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.256 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.741 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 20.9 tp -65.77 149.5 50.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.598 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -76.51 132.99 39.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.405 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.552 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.6 p90 -160.09 167.5 27.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.464 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 7.7 tp10 -153.07 129.18 10.4 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.455 ' HA ' HG12 ' B' ' 30' ' ' VAL . 68.7 mt -78.03 111.24 14.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.348 0.594 . . . . 10.0 110.555 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 mm -78.77 -41.52 24.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.776 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -169.14 139.21 2.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.34 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.74 141.45 30.53 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 83.5 mt -111.02 -70.46 0.81 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.139 -0.624 . . . . 10.0 111.617 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.612 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.3 mm -132.86 139.61 49.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.061 0.458 . . . . 10.0 111.582 -177.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.416 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.7 p -124.62 123.61 66.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 107.807 -1.182 . . . . 10.0 107.807 177.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 41.4 mt -92.73 -81.85 0.34 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.391 -0.524 . . . . 10.0 111.803 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.34 -170.45 0.22 Allowed 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 -179.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -102.84 139.39 38.47 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -79.08 -171.46 2.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.84 -17.82 65.08 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.431 0.634 . . . . 10.0 111.055 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -99.3 5.87 46.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.76 3.51 90.47 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.529 -0.843 . . . . 10.0 111.181 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -61.78 104.11 0.41 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.885 0.374 . . . . 10.0 111.039 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.7 tpp85 -82.82 100.0 10.05 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.621 179.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.53 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.6 mttt -82.11 117.47 22.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.899 0.381 . . . . 10.0 110.758 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.416 ' HG2' HG23 ' B' ' 15' ' ' VAL . 58.3 mt-10 -131.67 146.78 52.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.08 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.562 HD13 ' HB ' ' B' ' 41' ' ' ILE . 44.3 tp -117.56 107.16 13.93 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.011 -1.107 . . . . 10.0 108.011 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -135.22 161.81 34.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.498 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -99.43 115.05 28.37 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.455 HG12 ' HA ' ' B' ' 9' ' ' ILE . 23.0 m -124.63 159.37 30.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.76 -178.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.464 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 2.4 p -95.8 124.01 39.63 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.306 179.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -63.84 112.64 2.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.678 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 58.63 29.46 18.55 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.472 -177.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 62.94 32.96 15.35 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.068 -0.969 . . . . 10.0 111.099 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.06 -70.7 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.95 0.352 . . . . 10.0 111.95 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -92.46 113.59 59.84 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.738 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.07 119.95 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.393 2.062 . . . . 10.0 110.753 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.559 ' HE3' HG21 ' B' ' 56' ' ' THR . 19.4 ttpt -148.9 163.9 36.08 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.709 0.29 . . . . 10.0 110.37 -178.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -87.63 135.57 33.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.922 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -149.13 132.22 16.3 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.562 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.9 tt -106.84 123.58 61.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.206 0.527 . . . . 10.0 109.855 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.554 HH21 H2'' ' C' ' 14' ' ' ' DT' . 2.7 mtt85 -144.56 179.78 7.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.234 -177.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.53 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -126.23 144.87 50.62 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.037 -0.528 . . . . 10.0 109.954 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 36.4 m95 -117.8 174.52 6.13 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.039 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -79.08 160.08 71.84 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.713 -0.477 . . . . 10.0 109.713 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.63 -27.23 84.45 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.193 1.929 . . . . 10.0 112.103 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -95.78 -4.33 44.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.272 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.06 31.81 20.76 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.117 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -89.18 -39.77 13.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.982 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -131.63 173.17 11.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.872 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.421 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -150.95 172.45 15.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.772 -177.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.573 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -132.21 -159.72 9.42 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.318 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -93.65 156.97 16.4 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.083 -0.657 . . . . 10.0 112.262 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.62 -128.41 1.91 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.766 -0.934 . . . . 10.0 110.766 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.6 tt -146.84 143.47 20.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 117.618 0.709 . . . . 10.0 110.796 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.559 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.1 m -100.83 144.52 29.68 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.771 -0.649 . . . . 10.0 111.642 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -123.62 127.29 48.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.051 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -77.03 165.98 23.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.142 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -59.82 -47.69 84.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.53 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.0 pt-20 -65.65 -43.74 88.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.897 0.38 . . . . 10.0 110.866 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 73.0 mt-10 -62.41 -47.37 84.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.414 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.42 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.0 t80 -61.96 -41.36 97.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.727 -0.67 . . . . 10.0 110.612 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.59 -53.28 47.33 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.197 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.53 HG23 ' O ' ' B' ' 60' ' ' GLU . 23.3 t -61.33 -47.47 93.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 10.0 110.216 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.5 tp -53.62 -51.62 62.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.889 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.463 ' HB3' HD11 ' A' ' 73' ' ' LEU . 56.6 mt -61.07 -48.61 80.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.139 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -52.05 -51.21 59.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.463 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.714 ' HB3' HD12 ' A' ' 14' ' ' ILE . 58.9 mm-40 -66.57 -50.73 62.15 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.67 -0.695 . . . . 10.0 111.582 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.658 ' HB3' HD22 ' A' ' 66' ' ' LEU . 95.6 mt -60.58 -40.74 92.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.952 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.54 -40.81 99.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.51 -0.853 . . . . 10.0 111.092 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -72.0 -28.68 63.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.644 0.259 . . . . 10.0 111.215 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -66.01 -26.45 67.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.593 0.22 . . . . 10.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.585 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.0 mt -90.07 -10.27 45.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.944 -0.303 . . . . 10.0 111.514 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.425 -0.798 . . . . 10.0 109.89 179.712 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.513 -0.55 0 C3'-C2'-C1' 101.628 -0.766 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.468 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 C3'-C2'-C1' 101.383 -0.941 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . 0.468 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.885 0 O4'-C1'-C2' 104.132 -1.789 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.681 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 O4'-C4'-C3' 103.481 -2.119 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.483 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.796 0 O4'-C4'-C3' 103.452 -2.148 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.863 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.52 -0.797 0 C5'-C4'-O4' 113.203 2.377 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . 0.486 " H2'" ' NZ ' ' A' ' 38' ' ' LYS . . . . . . . . 0 O5'--C5' 1.425 -0.951 0 C3'-C2'-C1' 101.306 -0.996 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.867 0 C3'-C2'-C1' 101.51 -0.85 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . 0.43 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 C3'-C2'-C1' 101.877 -0.588 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.43 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.862 0 O4'-C1'-C2' 104.353 -1.589 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.741 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 O4'-C4'-C3' 103.555 -2.045 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.498 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.425 -0.927 0 O4'-C4'-C3' 103.631 -1.969 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.875 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.737 0 C5'-C4'-O4' 113.026 2.266 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.996 0 C3'-C2'-C1' 101.195 -1.075 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 121.003 0.43 . . . . 10.0 110.564 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.44 172.67 7.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.024 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -74.7 -51.8 13.31 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.742 -0.466 . . . . 10.0 109.742 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.53 94.05 3.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.946 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.741 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 25.5 tp -65.17 144.47 57.18 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.401 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 14.7 tppt? -78.1 130.84 36.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.932 0.396 . . . . 10.0 110.471 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.604 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 11.3 p90 -157.0 172.33 18.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.644 179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.402 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.5 tp10 -154.88 134.76 12.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.417 ' HA ' HG12 ' A' ' 30' ' ' VAL . 56.4 mt -82.87 111.65 19.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 10.0 110.56 -179.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.3 mm -81.12 -47.66 19.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.507 -0.769 . . . . 10.0 110.201 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -160.99 130.82 4.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.001 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.61 129.07 35.14 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.555 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 55.8 mt -98.95 -75.66 0.55 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.285 -0.566 . . . . 10.0 111.632 -178.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.662 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.8 mm -134.39 141.11 44.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.992 0.425 . . . . 10.0 112.029 -177.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.1 p -121.8 122.67 67.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.087 -1.079 . . . . 10.0 108.087 177.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.589 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.8 mt -90.78 -80.65 0.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.303 -0.559 . . . . 10.0 111.882 -177.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -175.17 -167.62 0.28 Allowed 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.475 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 3.5 mp0 -115.84 134.77 54.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.792 0.33 . . . . 10.0 110.338 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -73.12 -174.2 1.49 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.15 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.51 -26.12 68.56 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 121.553 0.692 . . . . 10.0 110.418 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.414 ' HG2' ' C2 ' ' C' ' 1' ' ' ' DT' . 23.0 mttt -85.24 -2.04 57.61 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.0 -1.0 . . . . 10.0 110.868 -179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.75 6.19 83.12 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.76 -0.936 . . . . 10.0 110.76 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.475 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.3 m0 -62.01 103.66 0.39 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.031 0.443 . . . . 10.0 111.513 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.551 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.6 tpp85 -80.88 99.1 8.16 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.29 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HG2' HG22 ' A' ' 43' ' ' THR . 90.8 mttt -83.2 113.26 20.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.064 0.459 . . . . 10.0 110.614 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.405 ' HG2' HG23 ' A' ' 15' ' ' VAL . 64.1 mt-10 -132.01 150.06 52.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.416 -0.811 . . . . 10.0 111.238 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.688 HD13 ' HB ' ' A' ' 41' ' ' ILE . 44.6 tp -117.85 109.34 16.43 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.664 -1.236 . . . . 10.0 107.664 178.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -134.76 156.94 47.97 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.087 0.47 . . . . 10.0 111.326 -177.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.1 ttm180 -96.85 114.55 26.19 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 10.0 108.781 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.417 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.8 m -126.73 159.98 35.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.8 0.334 . . . . 10.0 110.943 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.0 OUTLIER -95.62 122.99 38.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.316 179.125 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -64.47 111.43 2.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.897 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.2 m-80 59.47 29.07 18.59 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.816 0.698 . . . . 10.0 110.286 -178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.4 t0 66.72 24.42 9.97 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.468 -1.242 . . . . 10.0 111.143 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.69 -91.58 0.44 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.534 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -83.88 123.92 75.34 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.722 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.9 Cg_endo -82.29 122.59 3.72 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.025 2.483 . . . . 10.0 111.701 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -142.89 164.56 29.75 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.769 -0.373 . . . . 10.0 110.128 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -89.35 128.86 35.94 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -139.71 131.46 27.45 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.688 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.5 tt -108.0 121.28 60.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.521 0.676 . . . . 10.0 109.952 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.489 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.5 mtt85 -144.75 -178.14 5.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.56 -0.745 . . . . 10.0 111.069 -177.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.551 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -126.11 144.41 50.75 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.781 179.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -117.14 179.75 3.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.894 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 p -81.95 161.37 60.88 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 -32.19 93.68 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.292 1.995 . . . . 10.0 112.156 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.96 -5.96 54.72 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.403 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 62.12 36.26 15.25 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.545 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 50' ' ' LYS . 8.8 pt-20 -93.89 -40.48 10.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.857 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.404 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 43.6 mmtm -126.94 172.26 10.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.448 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.47 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -152.45 173.34 15.24 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.35 -177.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.546 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -134.06 -161.37 9.59 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.263 -0.97 . . . . 10.0 112.589 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -89.87 154.83 19.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.003 0.43 . . . . 10.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.429 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.35 -128.02 1.52 Allowed Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.163 -0.926 . . . . 10.0 111.156 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -143.33 143.5 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 117.755 0.777 . . . . 10.0 111.192 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.06 140.81 39.28 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.323 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.39 128.71 49.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.544 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 69.8 m -84.34 170.24 13.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.492 -0.322 . . . . 10.0 110.551 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -52.9 -51.94 59.39 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.106 0.78 . . . . 10.0 113.106 -178.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.99 -46.67 86.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.743 0.306 . . . . 10.0 111.463 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.07 -48.73 78.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.21 0.528 . . . . 10.0 110.67 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.648 ' CE2' HD11 ' A' ' 66' ' ' LEU . 32.9 t80 -61.77 -43.11 99.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.217 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.68 -52.41 53.21 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.862 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.416 ' HB ' HD22 ' B' ' 16' ' ' LEU . 58.7 t -60.62 -41.55 88.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.14 0.495 . . . . 10.0 110.083 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.7 tp -59.11 -55.25 37.42 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.422 -0.808 . . . . 10.0 110.667 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.689 HD22 ' HB3' ' B' ' 69' ' ' LEU . 16.5 mt -59.45 -47.02 87.09 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -48.86 -55.59 11.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.593 -0.73 . . . . 10.0 111.626 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.547 ' CB ' HD12 ' B' ' 14' ' ' ILE . 62.6 mm-40 -72.28 -41.99 66.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.768 -178.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.0 mt -59.66 -45.89 90.67 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.637 0.256 . . . . 10.0 111.583 -179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.06 -36.78 93.41 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.367 -0.921 . . . . 10.0 111.076 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -67.55 -25.0 65.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 10.0 110.891 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.7 mmtt -72.37 -26.88 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.447 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.484 HD11 ' HB3' ' B' ' 66' ' ' LEU . 35.2 mt -88.14 -18.74 28.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.637 0.256 . . . . 10.0 111.009 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.594 -0.717 . . . . 10.0 111.044 -179.529 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 120.897 0.38 . . . . 10.0 110.425 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.82 167.06 10.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.403 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 31.6 t70 -70.82 -53.98 13.29 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.403 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 20.7 mmtm -132.76 94.26 3.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.835 179.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.708 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 27.2 tp -65.57 142.23 58.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.808 0.337 . . . . 10.0 110.268 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 15.9 tppt? -75.26 126.98 32.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.58 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.671 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 10.9 p90 -153.01 171.69 17.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.914 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.531 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.7 tp10 -155.15 132.01 10.73 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.435 ' HA ' HG12 ' B' ' 30' ' ' VAL . 53.4 mt -81.22 114.46 22.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.203 0.525 . . . . 10.0 110.633 -179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.1 mm -86.42 -41.0 14.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -166.17 130.04 2.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.651 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.86 132.24 39.05 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.736 -0.838 . . . . 10.0 108.736 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 29.3 mt -102.97 -72.91 0.68 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.384 -0.526 . . . . 10.0 111.76 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.547 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.0 mm -136.66 137.94 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.918 0.389 . . . . 10.0 112.016 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 p -119.0 122.98 70.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . 0.416 HD22 ' HB ' ' A' ' 64' ' ' VAL . 38.6 mt -90.67 -80.34 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.599 -0.44 . . . . 10.0 111.433 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -177.06 -167.18 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.3 mt-10 -115.78 136.43 53.06 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.924 -0.398 . . . . 10.0 109.924 179.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -74.14 -175.35 2.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.214 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.83 -25.64 68.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.289 0.566 . . . . 10.0 110.751 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -86.12 0.51 53.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.52 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 6.36 85.14 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.284 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.501 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -62.5 104.31 0.5 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.971 0.415 . . . . 10.0 111.705 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.538 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.2 tpp85 -80.56 99.57 8.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.272 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.605 ' HG2' HG22 ' B' ' 43' ' ' THR . 91.5 mttt -83.2 114.09 21.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.969 0.414 . . . . 10.0 110.798 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -133.67 151.56 51.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.756 HD13 ' HB ' ' B' ' 41' ' ' ILE . 48.3 tp -119.01 109.07 15.51 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.539 -1.282 . . . . 10.0 107.539 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -133.95 156.59 47.87 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.152 0.501 . . . . 10.0 111.209 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -96.71 114.33 25.96 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' B' ' 9' ' ' ILE . 14.5 m -126.65 160.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.86 0.362 . . . . 10.0 110.86 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.531 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -96.53 123.02 40.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.371 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -64.07 111.23 2.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.903 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.421 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 66.2 m-80 60.12 29.32 18.91 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.064 -178.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.8 t70 69.38 16.04 8.35 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.176 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.15 -93.56 0.32 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.164 0.431 . . . . 10.0 112.164 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -80.03 122.62 83.32 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.792 0.33 . . . . 10.0 111.751 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 82.9 Cg_endo -82.16 124.38 4.3 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.894 2.396 . . . . 10.0 111.591 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -143.78 165.69 26.98 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -91.14 128.7 37.06 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t0 -139.15 130.19 26.51 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.756 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.2 tt -106.18 121.55 58.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 121.441 0.638 . . . . 10.0 109.934 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.521 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.1 mtt85 -144.88 -178.07 5.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.257 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.605 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.85 144.77 50.52 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.123 -0.489 . . . . 10.0 109.937 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -117.41 179.54 4.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.12 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.73 161.75 57.59 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.42 -35.28 96.19 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.312 2.008 . . . . 10.0 112.082 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -89.17 -5.47 57.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.549 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.55 37.24 16.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.898 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -94.04 -39.7 10.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.632 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -128.77 169.87 14.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.015 0.436 . . . . 10.0 110.942 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.467 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -149.68 172.83 14.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.343 -177.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.502 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -133.72 -162.83 10.19 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.959 -0.638 . . . . 10.0 112.212 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -89.11 153.45 20.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.202 0.525 . . . . 10.0 112.197 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.435 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -147.32 -128.73 1.87 Allowed Glycine 0 C--N 1.331 0.282 0 N-CA-C 110.645 -0.982 . . . . 10.0 110.645 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -143.37 141.97 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 117.665 0.733 . . . . 10.0 111.13 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.11 142.25 35.22 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.254 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 57.1 mt -125.76 126.45 44.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.582 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.9 m -79.92 171.52 15.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.25 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -55.85 -52.51 63.78 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.301 0.482 . . . . 10.0 112.301 -178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.589 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.3 pt-20 -60.88 -44.59 96.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.787 0.327 . . . . 10.0 111.447 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -64.39 -49.59 71.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.001 0.429 . . . . 10.0 110.848 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -62.65 -39.32 93.51 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.908 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.97 -54.02 40.92 Favored Glycine 0 C--N 1.328 0.128 0 C-N-CA 121.163 -0.541 . . . . 10.0 112.961 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.589 ' HB ' HD22 ' A' ' 16' ' ' LEU . 13.0 t -61.36 -39.68 83.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.161 0.505 . . . . 10.0 109.904 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.0 tp -59.87 -55.11 38.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.278 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.484 ' HB3' HD11 ' A' ' 73' ' ' LEU . 75.5 mt -58.03 -49.47 76.74 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.212 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.7 tttm -49.14 -57.18 7.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.016 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.662 ' HB3' HD12 ' A' ' 14' ' ' ILE . 65.5 mm-40 -70.48 -42.91 70.77 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.24 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.689 ' HB3' HD22 ' A' ' 66' ' ' LEU . 49.0 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.609 0.226 . . . . 10.0 111.609 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.95 -35.66 92.29 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . 0.41 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 10.6 t-20 -70.3 -27.26 64.25 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.951 0.405 . . . . 10.0 111.143 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 52.1 mmtt -69.0 -27.11 65.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.594 -0.276 . . . . 10.0 111.59 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 66' ' ' LEU . 27.6 mt -89.91 -5.81 56.39 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.774 -0.37 . . . . 10.0 111.63 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.41 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.2 mt-10 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.663 -0.684 . . . . 10.0 110.362 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . 0.414 ' C2 ' ' HG2' ' A' ' 21' ' ' LYS . . . . . . . . 0 C2'--C1' 1.514 -0.529 0 C3'-C2'-C1' 101.698 -0.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.809 0 C3'-C2'-C1' 101.53 -0.836 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.921 0 O4'-C1'-C2' 104.256 -1.676 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.741 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.521 -0.706 0 O4'-C4'-C3' 103.567 -2.033 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.489 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C4'-C3' 103.45 -2.15 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.857 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.865 0 C5'-C4'-O4' 113.119 2.325 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 101.171 -1.092 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.999 0 C3'-C2'-C1' 101.449 -0.894 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.04 0 C3'-C2'-C1' 101.923 -0.555 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.454 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.409 -0.829 0 O4'-C1'-C2' 104.38 -1.564 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.708 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.519 -0.932 0 O4'-C4'-C3' 103.52 -2.08 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.488 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.896 0 O4'-C4'-C3' 103.814 -1.786 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.853 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.531 0.746 0 C5'-C4'-O4' 113.068 2.293 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 101.142 -1.113 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.622 0.249 . . . . 10.0 110.749 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.14 150.25 25.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.519 -0.548 . . . . 10.0 109.519 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.461 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 36.8 t70 -63.35 -41.16 98.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.846 0.355 . . . . 10.0 110.574 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 21.3 mmtm -135.79 103.56 5.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.062 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.748 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.0 tp -87.31 142.2 28.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -75.28 126.32 30.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.29 0.567 . . . . 10.0 110.744 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.466 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 12.3 p90 -146.34 169.71 18.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.637 -0.711 . . . . 10.0 109.154 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.487 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.0 tp10 -153.84 122.1 6.14 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.443 ' HA ' HG12 ' A' ' 30' ' ' VAL . 64.4 mt -73.23 112.97 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.078 0.466 . . . . 10.0 110.362 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -85.16 -42.76 16.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.144 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -165.48 134.23 3.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.853 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -85.71 133.25 34.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.4 mt -102.15 -75.8 0.59 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.5 -0.48 . . . . 10.0 111.9 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.65 HD12 ' HB3' ' B' ' 68' ' ' GLU . 35.6 mm -131.74 137.27 55.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.568 0.581 . . . . 10.0 112.568 -177.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.426 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.0 p -116.31 120.68 65.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.219 -1.03 . . . . 10.0 108.219 177.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.3 mt -87.77 -81.44 0.24 Allowed 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.386 -0.526 . . . . 10.0 111.768 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m -178.29 -168.69 0.16 Allowed 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.63 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 14.8 mp0 -114.48 139.04 49.87 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.204 0.315 . . . . 10.0 110.924 179.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -76.1 -171.81 1.82 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.318 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.92 -26.45 68.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.311 0.577 . . . . 10.0 111.173 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.594 ' HD3' H2'' ' C' ' 1' ' ' ' DT' . 47.1 mttt -88.51 1.8 54.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.361 -0.836 . . . . 10.0 111.133 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.24 4.38 88.16 Favored Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.68 ' HB3' HG21 ' A' ' 43' ' ' THR . 37.9 m0 -57.74 107.96 0.51 Allowed 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.259 -0.47 . . . . 10.0 111.911 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.9 tpp85 -86.86 104.86 16.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.889 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.539 ' CG ' HG23 ' A' ' 43' ' ' THR . 83.3 mttt -91.68 117.41 29.72 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.277 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.426 ' HG2' HG23 ' A' ' 15' ' ' VAL . 58.2 mt-10 -135.55 147.86 48.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.466 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.755 HD13 ' HB ' ' A' ' 41' ' ' ILE . 39.4 tp -114.02 108.18 16.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.11 -0.95 . . . . 10.0 108.578 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -135.1 169.24 17.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.933 0.397 . . . . 10.0 110.832 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.446 ' HD3' ' CE1' ' A' ' 39' ' ' TYR . 10.0 ttp180 -108.86 118.01 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.9 m -127.16 161.33 34.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.724 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.487 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.8 p -96.48 123.58 40.19 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.217 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.4 109.25 1.86 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.714 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 62.1 23.96 14.2 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.301 0.572 . . . . 10.0 109.826 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t0 66.6 23.68 10.3 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.521 -1.218 . . . . 10.0 111.088 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.47 -79.64 0.52 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.901 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -98.32 125.05 44.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.583 -179.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.0 Cg_endo -82.21 125.88 4.74 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.801 2.334 . . . . 10.0 111.66 178.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.2 ttmm -146.38 163.92 34.08 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.446 ' CE1' ' HD3' ' A' ' 29' ' ' ARG . 7.6 m-85 -84.68 129.65 34.81 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.188 -0.301 . . . . 10.0 110.188 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.465 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 10.8 t0 -143.32 127.32 17.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.755 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -105.09 123.41 59.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 CA-C-O 121.154 0.502 . . . . 10.0 109.729 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.533 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtp85 -142.91 -179.17 6.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.389 0.614 . . . . 10.0 112.27 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.68 HG21 ' HB3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -124.26 135.75 53.64 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.715 -1.129 . . . . 10.0 110.404 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.2 m0 -122.37 165.34 16.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.721 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -67.98 152.53 96.34 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.121 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.19 -35.88 95.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.85 2.367 . . . . 10.0 113.109 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.48 -4.92 59.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.949 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 63.0 28.94 16.43 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.833 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.419 ' H ' ' HG2' ' A' ' 49' ' ' GLU . 9.7 pt-20 -79.18 -35.41 41.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.705 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.3 mmmm -141.08 174.55 10.41 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.328 0.585 . . . . 10.0 111.63 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.527 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -135.57 168.06 19.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.888 -1.051 . . . . 10.0 110.889 -178.202 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.58 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -132.38 -171.77 12.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.056 -0.593 . . . . 10.0 112.144 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 35.7 mttp -90.97 151.62 21.01 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.154 -0.615 . . . . 10.0 111.838 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.07 -123.48 1.44 Allowed Glycine 0 C--N 1.333 0.398 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.6 141.07 15.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 121.366 0.603 . . . . 10.0 111.751 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.72 143.41 30.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.75 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.5 mt -119.77 128.4 53.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.378 -0.373 . . . . 10.0 110.258 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.8 m -76.16 162.93 27.57 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -56.64 -48.66 77.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.024 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -64.26 -43.39 95.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.004 0.431 . . . . 10.0 110.717 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.15 -51.89 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.289 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.41 -36.75 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.65 -52.49 52.16 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 121.201 -0.523 . . . . 10.0 112.032 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.1 t -64.63 -41.96 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.957 0.408 . . . . 10.0 110.075 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.447 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 13.0 tp -56.46 -52.86 63.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.443 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.872 ' HB3' HD11 ' B' ' 73' ' ' LEU . 19.0 mt -62.07 -47.04 86.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.917 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -50.48 -52.91 33.93 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 123.558 0.536 . . . . 10.0 111.115 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 7.5 mm-40 -70.35 -51.51 29.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.649 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.482 ' HB3' HD22 ' B' ' 66' ' ' LEU . 72.8 mt -55.37 -45.89 76.53 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -178.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.48 -39.27 97.08 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.688 -0.768 . . . . 10.0 111.34 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -72.89 -26.77 61.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.82 0.343 . . . . 10.0 110.882 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.662 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 40.5 mmtt -67.32 -30.21 69.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.548 -0.296 . . . . 10.0 110.479 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' B' ' 66' ' ' LEU . 26.0 mt -77.34 -22.2 52.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.274 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.629 -0.7 . . . . 10.0 110.389 -179.714 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.965 0.412 . . . . 10.0 110.315 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.39 150.77 23.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.22 -0.446 . . . . 10.0 109.817 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' B' ' 4' ' ' LYS . 29.0 t70 -63.79 -41.34 97.95 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.116 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.456 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 31.1 mmtm -134.35 104.82 6.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.952 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.746 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 23.7 tp -88.2 141.4 28.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 28.4 tptt -75.81 124.66 27.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.418 0.628 . . . . 10.0 110.66 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.558 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.5 p90 -144.58 168.37 20.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.22 -0.9 . . . . 10.0 108.839 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.476 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 12.7 tp10 -151.68 119.71 6.25 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.615 ' HA ' HG12 ' B' ' 30' ' ' VAL . 63.8 mt -70.86 110.79 4.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.066 0.46 . . . . 10.0 110.275 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 34.7 mm -83.44 -43.45 18.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.278 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -164.08 132.92 3.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.953 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -83.9 135.04 34.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 62.7 mt -105.51 -74.74 0.64 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.547 -0.461 . . . . 10.0 111.845 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.522 HD12 ' CB ' ' A' ' 68' ' ' GLU . 17.5 mm -130.77 137.23 56.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.434 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.5 p -117.56 118.14 57.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.168 -1.049 . . . . 10.0 108.168 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -86.68 -81.69 0.22 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.441 -0.504 . . . . 10.0 111.716 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.68 -168.83 0.15 Allowed 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.835 0.454 . . . . 10.0 109.81 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.634 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 15.7 mp0 -113.59 141.53 47.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.517 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -76.98 -169.41 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.764 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.21 -20.71 64.86 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.142 0.496 . . . . 10.0 111.041 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . 0.62 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 42.4 mttt -91.51 1.32 57.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.694 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.46 3.01 84.63 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.006 -0.838 . . . . 10.0 111.006 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.681 ' HB3' HG21 ' B' ' 43' ' ' THR . 38.1 m0 -57.07 108.96 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.315 -0.443 . . . . 10.0 112.152 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.2 tpp85 -87.5 105.52 17.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.132 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.527 ' HG2' HG23 ' B' ' 43' ' ' THR . 70.2 mttt -91.82 116.47 28.93 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.945 0.402 . . . . 10.0 110.465 179.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.434 ' HG2' HG23 ' B' ' 15' ' ' VAL . 57.2 mt-10 -134.51 146.87 50.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.069 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.8 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.4 tp -113.73 108.41 17.07 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -134.89 169.1 17.9 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.856 0.36 . . . . 10.0 110.736 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.535 ' HD3' ' CE1' ' B' ' 39' ' ' TYR . 14.3 ttp180 -108.94 115.63 30.44 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.615 HG12 ' HA ' ' B' ' 9' ' ' ILE . 25.5 m -125.14 161.74 28.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.751 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.2 p -96.56 123.82 40.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.319 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.9 m0 -64.02 110.06 2.01 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.292 -0.632 . . . . 10.0 109.292 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.427 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.44 26.95 16.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.479 0.656 . . . . 10.0 110.039 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 39.2 t0 63.27 25.46 14.74 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 114.623 -1.171 . . . . 10.0 110.839 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -78.85 0.56 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.767 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.511 ' OE1' H2'' ' C' ' 17' ' ' ' DT' . 35.1 tt0 -99.08 122.59 51.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-O 120.697 0.284 . . . . 10.0 111.666 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.5 Cg_endo -80.14 126.97 6.56 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.922 2.414 . . . . 10.0 112.027 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.428 ' HD2' HG22 ' B' ' 56' ' ' THR . 18.1 ttmm -148.1 165.27 31.34 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . 0.535 ' CE1' ' HD3' ' B' ' 29' ' ' ARG . 7.0 m-85 -85.64 128.78 34.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.268 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 11.3 t0 -143.04 127.46 17.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.8 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.9 tt -105.47 123.28 59.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.552 HH21 H2'' ' C' ' 14' ' ' ' DT' . 4.8 mtp85 -143.12 -179.22 6.25 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.407 0.622 . . . . 10.0 112.373 -177.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.681 HG21 ' HB3' ' B' ' 23' ' ' TRP . 0.2 OUTLIER -123.73 136.72 54.61 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.263 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -122.5 166.39 14.86 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.624 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -69.69 152.52 96.14 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 10.0 109.953 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.02 -40.46 81.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.926 2.418 . . . . 10.0 113.0 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -84.98 -5.26 59.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 10.0 110.859 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 66.27 24.3 10.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.375 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -72.02 -38.93 69.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.823 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -138.5 174.55 10.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.467 0.651 . . . . 10.0 111.853 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.535 ' O ' " H1'" ' C' ' 13' ' ' ' DT' . 0.0 OUTLIER -135.49 166.98 21.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.671 -1.15 . . . . 10.0 110.631 -178.131 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.587 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -131.2 -169.28 12.39 Favored Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.126 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -92.33 146.92 23.33 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.169 -0.606 . . . . 10.0 111.914 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.404 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -141.22 -125.31 2.1 Favored Glycine 0 N--CA 1.453 -0.221 0 N-CA-C 110.7 -0.96 . . . . 10.0 110.7 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.1 tt -151.93 139.47 13.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 117.684 0.742 . . . . 10.0 111.55 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.428 HG22 ' HD2' ' B' ' 38' ' ' LYS . 0.9 OUTLIER -98.54 141.47 31.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.887 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 76.5 mt -118.45 129.32 55.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.486 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.7 m -73.67 164.58 26.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -60.08 -48.21 82.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.467 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.426 ' O ' HG23 ' B' ' 64' ' ' VAL . 14.7 pt-20 -63.53 -41.0 98.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.041 0.448 . . . . 10.0 110.739 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -63.49 -53.22 55.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.918 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.41 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.8 t80 -61.08 -36.78 80.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.291 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.51 -52.7 50.97 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.204 -0.522 . . . . 10.0 112.102 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.426 HG23 ' O ' ' B' ' 60' ' ' GLU . 60.5 t -64.02 -43.22 97.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.043 0.449 . . . . 10.0 109.887 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.52 -52.7 62.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.569 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.51 ' HB3' HD11 ' A' ' 73' ' ' LEU . 44.0 mt -60.6 -49.57 77.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.462 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -50.09 -54.07 22.97 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 123.523 0.515 . . . . 10.0 111.363 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.65 ' HB3' HD12 ' A' ' 14' ' ' ILE . 6.3 mm-40 -69.19 -52.98 22.45 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.655 -178.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.595 ' HB3' HD22 ' A' ' 66' ' ' LEU . 61.0 mt -56.36 -44.57 80.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.98 -38.62 95.79 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.972 -0.633 . . . . 10.0 111.644 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . 0.468 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.1 t-20 -75.67 -23.07 56.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.806 0.336 . . . . 10.0 111.013 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.1 mmtt -69.83 -26.07 64.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.507 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.872 HD11 ' HB3' ' A' ' 66' ' ' LEU . 22.0 mt -84.85 -12.57 53.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.974 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.468 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.9 mt-10 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.619 -0.705 . . . . 10.0 110.246 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . 0.594 H2'' ' HD3' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 O5'-C5'-C4' 109.108 -0.78 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.426 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.847 0 C3'-C2'-C1' 101.22 -1.057 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . 0.527 " H1'" ' O ' ' A' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.408 -0.951 0 O4'-C1'-C2' 103.616 -2.259 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.754 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.52 -0.773 0 O4'-C4'-C3' 103.814 -1.786 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.512 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -1.002 0 O4'-C4'-C3' 103.482 -2.118 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.885 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.815 0 C5'-C4'-O4' 113.326 2.454 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 C3'-C2'-C1' 100.971 -1.235 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . 0.62 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 C3'-C2'-C1' 101.106 -1.138 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . 0.411 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.933 0 C3'-C2'-C1' 101.636 -0.76 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.535 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O5'--C5' 1.426 -0.892 0 O4'-C1'-C2' 103.952 -1.953 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.746 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.893 0 O4'-C4'-C3' 103.707 -1.893 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.533 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.422 -1.13 0 O4'-C4'-C3' 103.945 -1.655 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.872 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.905 0 C5'-C4'-O4' 113.275 2.422 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.511 H2'' ' OE1' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 C3'-C2'-C1' 100.961 -1.242 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 mmt . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.83 0.348 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.0 171.86 7.25 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.499 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 34.3 t70 -71.15 -50.61 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.9 -0.408 . . . . 10.0 109.9 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 45.8 mmtm -140.66 120.86 13.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.668 178.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.846 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.3 tp -92.87 138.74 31.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.5 tppt? -72.03 128.71 36.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.459 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.506 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 9.5 p90 -156.11 163.17 39.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.483 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 6.7 tp10 -145.64 134.57 22.52 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.262 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.3 mt -84.3 110.36 18.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.402 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 41.2 mm -78.52 -47.62 23.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.763 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -162.32 134.62 5.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.905 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.62 137.26 37.76 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 72.2 mt -106.32 -75.94 0.62 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.157 -0.617 . . . . 10.0 111.44 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.612 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.5 mm -132.93 139.35 49.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -177.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.416 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -117.04 125.72 74.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 107.805 -1.183 . . . . 10.0 107.805 177.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.534 HD22 ' HB ' ' B' ' 64' ' ' VAL . 24.8 mt -95.66 -81.12 0.41 Allowed 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.984 -0.686 . . . . 10.0 112.033 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 m -176.35 -165.18 0.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 17.9 mt-10 -117.43 143.73 45.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.855 0.36 . . . . 10.0 110.53 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -80.21 -176.68 5.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.678 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.57 -21.43 66.34 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.607 0.718 . . . . 10.0 110.711 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.438 ' HD3' H2'' ' C' ' 1' ' ' ' DT' . 43.3 mttt -87.23 -6.31 58.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.087 -0.961 . . . . 10.0 110.556 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.23 3.46 72.6 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.076 -0.81 . . . . 10.0 111.076 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.563 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.4 m0 -60.77 108.15 0.81 Allowed 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.742 -0.229 . . . . 10.0 111.345 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' THR . 16.8 tpp85 -84.05 100.26 10.98 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.642 ' HG2' HG22 ' A' ' 43' ' ' THR . 80.0 mttt -84.51 114.15 21.74 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.75 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.416 ' HG2' HG23 ' A' ' 15' ' ' VAL . 73.3 mt-10 -134.06 147.73 50.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.875 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.708 HD13 ' HB ' ' A' ' 41' ' ' ILE . 37.2 tp -115.34 110.56 19.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.232 -0.895 . . . . 10.0 108.623 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.57 159.31 40.84 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.051 0.453 . . . . 10.0 111.304 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -95.75 113.94 25.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.9 m -126.85 159.33 36.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 120.94 0.4 . . . . 10.0 110.868 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.3 p -96.8 123.72 40.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.471 179.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.5 m0 -63.62 108.64 1.44 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.489 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.3 m-80 59.61 28.93 18.45 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.107 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 63.67 26.9 14.7 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 114.927 -1.033 . . . . 10.0 111.229 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.88 -70.49 0.79 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.646 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 40.1 tt0 -95.12 112.83 59.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.573 -0.285 . . . . 10.0 111.726 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 6.3 Cg_exo -77.06 120.38 5.39 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.018 2.479 . . . . 10.0 110.909 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.577 ' HE3' HG21 ' A' ' 56' ' ' THR . 19.5 ttpt -148.89 166.55 28.23 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.733 -0.387 . . . . 10.0 110.61 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -90.26 134.48 34.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.64 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.57 132.97 18.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.708 ' HB ' HD13 ' A' ' 27' ' ' LEU . 9.9 tt -109.78 122.84 65.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 121.321 0.581 . . . . 10.0 109.802 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.449 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.2 mtt85 -144.9 179.73 7.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.197 -178.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.642 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -125.1 144.21 50.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.256 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -117.78 171.03 8.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.798 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 m -70.28 157.55 89.65 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.92 -29.22 88.91 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.248 1.965 . . . . 10.0 112.016 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -94.34 -1.07 54.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.811 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 61.78 27.01 16.47 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.127 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -76.81 -36.19 57.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.417 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -139.25 174.66 10.28 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.52 0.676 . . . . 10.0 112.304 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.416 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -136.93 172.93 12.28 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.337 -1.301 . . . . 10.0 110.302 -178.118 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.476 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -143.09 -167.38 11.53 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 120.852 -0.69 . . . . 10.0 111.969 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -93.36 147.53 22.86 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.029 -0.689 . . . . 10.0 112.241 -179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.24 -117.89 1.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.576 -1.01 . . . . 10.0 110.576 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -151.29 141.27 15.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 117.348 0.574 . . . . 10.0 111.031 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.577 HG21 ' HE3' ' A' ' 38' ' ' LYS . 1.2 m -101.85 141.32 34.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.595 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.5 mt -119.28 129.41 54.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.164 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 t -79.5 168.35 19.56 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.854 -0.425 . . . . 10.0 109.854 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -58.39 -50.5 73.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.075 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.18 -41.91 98.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.041 0.448 . . . . 10.0 110.886 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.19 -54.02 44.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.016 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.691 ' CE2' HD11 ' A' ' 66' ' ' LEU . 33.1 t80 -56.78 -43.16 80.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.352 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.28 -52.5 52.89 Favored Glycine 0 CA--C 1.519 0.292 0 C-N-CA 121.327 -0.463 . . . . 10.0 113.155 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.73 -42.56 95.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.861 0.362 . . . . 10.0 110.482 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.456 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.4 tp -56.25 -51.35 68.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.804 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.703 HD22 ' HB3' ' B' ' 69' ' ' LEU . 21.5 mt -62.67 -46.61 87.37 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.467 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.9 tttm -50.83 -54.46 23.58 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.705 0.628 . . . . 10.0 111.352 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.579 ' CB ' HD12 ' B' ' 14' ' ' ILE . 9.2 mm-40 -66.9 -51.23 57.93 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.801 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 81.8 mt -57.5 -45.84 84.46 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.54 -39.37 97.56 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.884 -0.674 . . . . 10.0 111.767 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -68.6 -27.47 66.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.625 0.25 . . . . 10.0 111.142 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 75.3 mmtt -69.59 -28.71 66.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.866 0.365 . . . . 10.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' B' ' 66' ' ' LEU . 32.2 mt -89.67 -2.84 58.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.323 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.304 -0.855 . . . . 10.0 110.656 -179.608 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 23.7 mmt . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 120.834 0.35 . . . . 10.0 110.144 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.31 167.55 9.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.065 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.465 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 38.0 t70 -66.79 -54.33 23.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.141 0.496 . . . . 10.0 110.026 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.465 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 42.9 mmtm -139.44 118.07 12.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.349 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.81 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 24.8 tp -89.03 138.65 31.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.662 0.268 . . . . 10.0 110.494 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.0 tppt? -72.1 128.34 35.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.591 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.552 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 7.6 p90 -156.49 163.57 39.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.141 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -147.29 136.35 22.34 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.747 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -84.54 111.76 20.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.678 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.51 -45.33 23.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.176 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -165.47 131.53 2.66 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.478 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.4 139.95 41.15 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.527 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 70.0 mt -109.92 -73.69 0.68 Allowed 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.203 -0.599 . . . . 10.0 111.936 -178.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.579 HD12 ' CB ' ' A' ' 68' ' ' GLU . 16.4 mm -132.49 138.01 53.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.42 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.5 p -117.48 122.43 69.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.777 -1.194 . . . . 10.0 107.777 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 49.0 mt -93.25 -81.31 0.36 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.274 -0.57 . . . . 10.0 112.32 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.4 m -176.22 -166.45 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.562 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 48.6 mt-10 -117.91 140.24 49.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.684 0.278 . . . . 10.0 110.526 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -75.83 -176.01 3.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.057 -0.519 . . . . 10.0 109.927 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.9 -16.84 64.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.416 0.627 . . . . 10.0 110.785 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . 0.455 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 47.1 mttt -91.84 -4.79 54.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.375 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.7 2.07 73.0 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.621 -0.8 . . . . 10.0 111.412 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.562 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.0 m0 -59.45 107.05 0.52 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 120.805 0.335 . . . . 10.0 111.537 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' B' ' 43' ' ' THR . 15.6 tpp85 -82.96 100.2 10.27 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.655 ' HG2' HG22 ' B' ' 43' ' ' THR . 79.3 mttt -84.7 114.05 21.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.883 -179.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.42 ' HG2' HG23 ' B' ' 15' ' ' VAL . 64.8 mt-10 -135.22 147.4 49.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.681 . . . . 10.0 110.992 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.663 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.0 tp -114.4 110.76 20.38 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.258 -0.883 . . . . 10.0 108.906 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -133.73 158.94 42.03 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.038 0.446 . . . . 10.0 111.069 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -95.36 113.71 25.41 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 m -126.44 161.16 33.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.901 0.382 . . . . 10.0 110.778 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.479 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -98.52 124.24 43.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.565 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -64.08 108.13 1.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.573 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.403 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.0 m-80 60.07 29.5 19.06 Favored 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 123.783 0.677 . . . . 10.0 109.896 -177.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 27.9 t70 63.19 22.11 13.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 114.615 -1.175 . . . . 10.0 111.299 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.14 -66.6 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.035 -0.415 . . . . 10.0 111.785 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -98.44 112.13 61.59 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.479 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 56.5 Cg_endo -77.18 120.19 5.27 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.219 1.946 . . . . 10.0 110.872 178.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.536 ' HE3' HG21 ' B' ' 56' ' ' THR . 16.9 ttpt -147.81 170.39 17.72 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.014 -0.274 . . . . 10.0 110.509 -178.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -93.55 133.52 36.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.673 -0.24 . . . . 10.0 110.686 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.409 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -147.11 132.2 18.28 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.663 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.7 tt -108.08 122.72 62.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.275 0.56 . . . . 10.0 109.907 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.52 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.6 mtt85 -145.33 177.15 9.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.377 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.655 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -122.14 144.09 49.15 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.29 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 38.2 m95 -118.01 171.66 7.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.71 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.1 m -70.8 158.06 88.85 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -59.61 -29.5 90.0 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.179 1.919 . . . . 10.0 111.691 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -93.96 -3.29 51.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.869 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 61.49 29.96 18.6 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.498 -0.774 . . . . 10.0 110.744 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.29 -34.6 31.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.166 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mmtm -137.56 174.28 10.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.321 0.581 . . . . 10.0 112.113 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.408 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -138.72 172.4 12.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.085 -178.489 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.488 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -141.95 -164.23 9.96 Favored Glycine 0 C--O 1.226 -0.356 0 C-N-CA 120.631 -0.795 . . . . 10.0 112.195 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -96.8 143.44 27.72 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.095 -0.65 . . . . 10.0 112.139 -179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.405 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -136.55 -118.49 1.76 Allowed Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 110.338 -1.105 . . . . 10.0 110.338 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -152.4 141.38 14.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 117.59 0.695 . . . . 10.0 110.926 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.536 HG21 ' HE3' ' B' ' 38' ' ' LYS . 1.2 m -100.47 142.29 32.14 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.673 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 71.6 mt -120.41 128.78 53.52 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.19 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -77.36 169.23 18.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.29 -48.43 81.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.632 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.607 ' O ' HG23 ' B' ' 64' ' ' VAL . 10.6 pt-20 -62.37 -44.3 96.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.055 0.455 . . . . 10.0 110.486 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -61.31 -54.11 48.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.614 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.413 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -58.05 -40.47 81.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.687 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.55 -51.55 58.15 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 116.024 -0.535 . . . . 10.0 112.552 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.607 HG23 ' O ' ' B' ' 60' ' ' GLU . 15.1 t -65.74 -44.67 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 120.801 0.334 . . . . 10.0 110.387 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.1 tp -55.0 -51.75 65.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.919 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 73' ' ' LEU . 95.9 mt -60.48 -51.1 70.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.144 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.07 -57.61 5.58 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.758 0.661 . . . . 10.0 112.142 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.612 ' HB3' HD12 ' A' ' 14' ' ' ILE . 9.3 mm-40 -65.85 -50.39 64.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.068 -0.514 . . . . 10.0 112.146 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.703 ' HB3' HD22 ' A' ' 66' ' ' LEU . 78.6 mt -59.59 -44.97 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -178.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.69 -37.45 94.81 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.188 -0.529 . . . . 10.0 111.921 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -71.94 -27.34 62.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.818 0.342 . . . . 10.0 111.147 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.2 mmtt -66.07 -34.17 77.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.646 0.26 . . . . 10.0 111.051 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.469 HD11 ' CB ' ' A' ' 66' ' ' LEU . 23.6 mt -90.64 8.81 32.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.606 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.242 -0.885 . . . . 10.0 110.575 -180.0 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . 0.438 H2'' ' HD3' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C3'-C2'-C1' 101.603 -0.784 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.846 0 C3'-C2'-C1' 101.502 -0.855 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.914 0 O4'-C1'-C2' 104.16 -1.763 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.846 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O4'--C1' 1.428 0.627 0 O4'-C4'-C3' 103.429 -2.171 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.664 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.885 0 O4'-C4'-C3' 103.411 -2.189 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.863 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.909 0 C5'-C4'-O4' 113.109 2.318 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 C3'-C2'-C1' 101.011 -1.207 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . 0.455 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.872 0 C3'-C2'-C1' 101.627 -0.766 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . 0.423 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.919 0 C3'-C2'-C1' 101.803 -0.641 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.423 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.884 0 O4'-C1'-C2' 104.436 -1.512 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.81 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.804 0 O4'-C4'-C3' 103.569 -2.031 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.728 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.863 0 O4'-C4'-C3' 103.457 -2.143 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.9 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.917 0 C5'-C4'-O4' 113.217 2.386 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.016 0 C3'-C2'-C1' 101.252 -1.034 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 CA-C-O 120.757 0.313 . . . . 10.0 110.895 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.3 158.2 16.78 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.076 -0.342 . . . . 10.0 110.076 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.408 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 7.1 t70 -61.53 -50.06 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 10.0 110.392 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 40.7 mmtm -136.47 100.45 4.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.48 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.777 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 24.9 tp -75.61 140.52 42.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.8 tppt? -75.75 136.14 40.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.91 0.386 . . . . 10.0 110.937 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.475 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 11.4 p90 -158.92 174.85 14.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.506 -0.553 . . . . 10.0 109.506 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.463 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 9.0 tp10 -156.58 129.13 7.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.732 -0.469 . . . . 10.0 109.732 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.461 ' HA ' HG12 ' A' ' 30' ' ' VAL . 61.1 mt -80.75 119.02 29.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.945 0.402 . . . . 10.0 110.625 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.9 mm -90.33 -48.63 14.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.287 0.565 . . . . 10.0 110.204 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -162.38 128.43 3.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.865 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -74.72 144.65 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.844 -0.799 . . . . 10.0 108.844 178.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 80.4 mt -114.1 -72.98 0.67 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.579 -0.448 . . . . 10.0 112.096 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.649 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.3 mm -131.37 140.58 48.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.472 . . . . 10.0 112.196 -177.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.1 120.07 57.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 177.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.7 mt -89.3 -80.27 0.3 Allowed 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.68 -0.408 . . . . 10.0 111.837 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 m -179.04 -166.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.679 . . . . 10.0 109.168 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.6 mp0 -112.91 144.04 43.16 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.273 0.358 . . . . 10.0 110.366 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -81.57 -173.78 4.6 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.98 -21.74 66.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.674 0.749 . . . . 10.0 110.438 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -87.71 -5.61 58.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.059 -0.973 . . . . 10.0 110.534 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.11 4.26 74.86 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.692 -0.765 . . . . 10.0 111.303 -178.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.501 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -63.14 105.15 0.66 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.817 0.341 . . . . 10.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 43' ' ' THR . 8.1 tpp85 -83.71 100.13 10.69 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.446 178.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HG2' HG22 ' A' ' 43' ' ' THR . 88.8 mttt -82.94 114.95 21.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.112 0.482 . . . . 10.0 110.998 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -131.85 147.89 52.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.517 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.674 HD13 ' HB ' ' A' ' 41' ' ' ILE . 33.9 tp -118.19 109.5 16.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -133.25 161.76 33.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.026 0.441 . . . . 10.0 111.283 -178.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -96.27 113.96 25.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.153 -1.055 . . . . 10.0 108.153 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.461 HG12 ' HA ' ' A' ' 9' ' ' ILE . 16.8 m -129.75 158.53 42.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.698 0.285 . . . . 10.0 111.035 -178.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -95.92 124.85 40.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.001 0.429 . . . . 10.0 110.507 179.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -64.52 112.46 3.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.912 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.44 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 57.16 30.85 19.02 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.75 0.656 . . . . 10.0 110.579 -178.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.2 t70 63.02 30.22 16.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 114.708 -1.133 . . . . 10.0 111.096 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.17 -83.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.03 -0.419 . . . . 10.0 111.347 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -96.7 125.12 48.05 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.683 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.516 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 57.1 Cg_endo -77.93 132.7 11.93 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.726 2.284 . . . . 10.0 111.489 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -151.27 169.12 22.71 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -94.38 123.9 38.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.631 0.253 . . . . 10.0 110.406 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -137.27 129.96 30.16 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.674 ' HB ' HD13 ' A' ' 27' ' ' LEU . 8.8 tt -107.6 123.02 62.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.199 0.523 . . . . 10.0 109.896 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.543 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.1 mtt85 -145.23 179.44 7.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.343 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.558 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -124.3 145.55 49.33 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.953 179.426 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.438 ' CE3' ' HB3' ' A' ' 51' ' ' MET . 44.5 m95 -117.52 170.85 8.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.07 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -69.98 158.22 87.84 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.76 -34.95 92.53 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.605 2.204 . . . . 10.0 112.541 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -91.21 -0.52 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.596 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.2 30.17 19.14 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.786 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -84.46 -33.76 23.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.949 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -136.42 174.68 10.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.537 0.685 . . . . 10.0 111.819 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.484 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -141.27 173.25 11.66 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.702 -177.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.645 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.58 -157.36 7.25 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.605 -0.807 . . . . 10.0 112.412 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.5 mttm -96.14 151.01 19.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.496 -0.414 . . . . 10.0 111.934 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.26 -121.16 1.25 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.5 tt -152.75 141.79 14.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.407 0.603 . . . . 10.0 111.229 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.496 ' HB ' ' H71' ' C' ' 7' ' ' ' DT' . 0.3 OUTLIER -105.9 140.82 38.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.707 179.462 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.8 mt -121.15 135.22 55.2 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.398 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 m -76.46 164.31 26.1 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.907 -0.405 . . . . 10.0 109.907 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -58.97 -46.98 86.75 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.98 -44.75 94.29 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.136 0.493 . . . . 10.0 110.315 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.445 ' HB3' HD13 ' B' ' 16' ' ' LEU . 80.4 mt-10 -61.4 -52.05 66.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.746 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.693 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.0 t80 -56.77 -44.29 81.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.311 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.3 -47.73 89.64 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.344 -0.455 . . . . 10.0 112.72 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 92.9 t -68.45 -43.89 83.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.439 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.4 tp -56.35 -49.52 74.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.792 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.693 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.0 mt -64.27 -44.66 91.02 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 121.16 -0.216 . . . . 10.0 111.462 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.2 tttm -54.67 -50.3 68.54 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.477 0.486 . . . . 10.0 110.848 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.548 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 25.2 mm-40 -70.5 -48.76 54.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.425 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 47.8 mt -59.04 -44.2 91.76 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.06 -38.42 95.97 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.411 -0.9 . . . . 10.0 110.996 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -70.09 -25.25 63.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.35 -0.425 . . . . 10.0 110.941 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 29.5 mmmt -67.97 -28.84 67.79 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.039 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 28.7 mt -88.12 -7.8 56.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.876 0.37 . . . . 10.0 110.814 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.523 -0.751 . . . . 10.0 110.172 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 120.767 0.317 . . . . 10.0 110.5 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.48 155.93 19.52 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -60.69 -49.2 78.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 10.0 110.47 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -136.29 101.8 4.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.739 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 26.2 tp -77.74 139.45 39.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.7 tppt? -75.29 136.43 40.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.111 0.481 . . . . 10.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.562 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 11.0 p90 -160.47 171.73 18.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.31 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.414 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 10.5 tp10 -153.27 130.34 11.09 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.39 116.97 24.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.114 0.483 . . . . 10.0 110.805 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -88.32 -44.54 15.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.554 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -166.94 130.41 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.98 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.83 141.14 40.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 56.4 mt -113.16 -73.64 0.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.492 -0.483 . . . . 10.0 112.056 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.532 HD12 ' CB ' ' A' ' 68' ' ' GLU . 17.0 mm -128.84 139.43 51.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.1 0.476 . . . . 10.0 112.032 -177.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.8 p -124.44 120.69 59.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 61' ' ' GLU . 29.0 mt -91.11 -81.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.875 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -179.16 -166.35 0.09 Allowed 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.506 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -113.03 140.23 48.01 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.882 0.372 . . . . 10.0 110.829 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . 0.404 ' OD1' ' HE3' ' B' ' 25' ' ' LYS . 11.9 m120 -77.31 -174.63 3.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.177 178.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.18 -18.79 65.57 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.381 0.61 . . . . 10.0 110.599 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -90.37 -5.72 55.85 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.424 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.58 69.2 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 111.247 -0.741 . . . . 10.0 111.247 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.506 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -64.48 104.92 0.85 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.68 0.276 . . . . 10.0 111.373 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.544 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.7 tpp85 -83.12 101.34 11.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.448 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.559 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.4 mttt -84.29 116.81 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.2 0.524 . . . . 10.0 111.073 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -134.12 146.73 50.52 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.364 -0.835 . . . . 10.0 110.659 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.719 HD13 ' HB ' ' B' ' 41' ' ' ILE . 39.1 tp -116.63 111.25 19.6 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.2 159.27 42.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.086 0.469 . . . . 10.0 111.296 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -93.38 114.25 26.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 m -130.42 157.82 42.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.921 0.391 . . . . 10.0 111.036 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.515 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 0.1 OUTLIER -95.23 124.59 39.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.585 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -64.17 110.91 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.01 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.0 m-80 58.84 30.03 19.56 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 123.859 0.724 . . . . 10.0 110.473 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 30.8 t70 64.84 28.02 12.84 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.676 -1.147 . . . . 10.0 111.034 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.15 -83.28 0.59 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.018 -0.426 . . . . 10.0 111.746 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.596 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 30.0 tt0 -96.03 122.48 58.14 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.658 -0.246 . . . . 10.0 111.509 -178.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.515 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.1 Cg_endo -76.69 129.55 10.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.976 2.451 . . . . 10.0 111.866 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -148.13 169.79 19.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.155 -0.313 . . . . 10.0 110.155 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -94.99 122.53 37.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.404 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.409 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -136.48 131.79 34.47 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.719 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.4 tt -108.92 122.44 63.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.207 0.527 . . . . 10.0 110.02 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.506 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.3 mtt85 -144.89 -179.71 6.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.44 -177.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.559 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -125.25 145.91 49.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.066 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 45.9 m95 -117.84 171.25 8.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.182 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 4.3 m -70.34 157.93 88.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.9 -0.407 . . . . 10.0 109.9 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -56.07 -32.05 85.04 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.601 2.201 . . . . 10.0 112.728 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.94 -3.55 51.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.099 0.476 . . . . 10.0 110.263 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 31.82 12.48 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.973 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -86.34 -30.86 21.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.032 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -137.91 174.41 10.6 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.401 0.62 . . . . 10.0 111.893 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.483 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -141.38 173.07 11.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.883 -1.053 . . . . 10.0 110.324 -177.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.668 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.18 -157.24 7.39 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.226 179.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.42 147.13 26.7 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.033 -0.686 . . . . 10.0 111.967 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -139.98 -119.48 1.64 Allowed Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 110.724 -0.95 . . . . 10.0 110.724 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.5 tt -152.84 143.23 15.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 117.308 0.554 . . . . 10.0 111.005 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.46 140.46 38.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.85 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 48.2 mt -121.27 135.0 55.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.497 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.42 164.44 25.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.15 -0.477 . . . . 10.0 109.866 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -60.32 -44.86 95.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.43 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.479 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.1 pt-20 -63.35 -41.52 98.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.117 0.484 . . . . 10.0 110.637 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -64.07 -50.54 67.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.246 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.477 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 4.1 t80 -59.22 -41.41 88.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.406 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.23 -50.89 62.99 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.088 -0.577 . . . . 10.0 112.334 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 60' ' ' GLU . 47.6 t -66.12 -45.83 89.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.058 0.456 . . . . 10.0 110.413 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.5 tp -55.3 -49.72 71.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.629 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 76.9 mt -61.77 -47.47 85.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.943 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -54.4 -52.4 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.588 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.649 ' HB3' HD12 ' A' ' 14' ' ' ILE . 7.5 mm-40 -68.82 -50.08 53.11 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.551 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.634 ' HB3' HD22 ' A' ' 66' ' ' LEU . 46.9 mt -60.09 -44.45 94.78 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.674 0.25 . . . . 10.0 111.674 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.07 -35.76 91.93 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.306 -0.718 . . . . 10.0 111.306 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -75.04 -25.19 58.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.87 0.367 . . . . 10.0 110.756 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 23.5 mmmt -64.9 -30.82 71.84 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.179 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.487 HD11 ' CB ' ' A' ' 66' ' ' LEU . 26.7 mt -89.29 0.42 56.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.186 -179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.691 -0.671 . . . . 10.0 109.358 179.158 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.766 0 C3'-C2'-C1' 101.668 -0.737 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C3'-C2'-C1' 101.539 -0.829 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.926 0 O4'-C1'-C2' 104.134 -1.787 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.777 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.521 -0.701 0 O4'-C4'-C3' 103.599 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.403 " O5'" HD22 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 O4'-C4'-C3' 103.552 -2.048 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.845 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.915 0 C5'-C4'-O4' 112.981 2.238 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . 0.496 ' H71' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 C3'-C2'-C1' 101.327 -0.98 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C3'-C2'-C1' 101.399 -0.93 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 C3'-C2'-C1' 101.857 -0.602 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.409 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 O4'-C1'-C2' 104.393 -1.552 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.739 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C4'-C3' 103.638 -1.962 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.514 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C4'-C3' 103.736 -1.864 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.863 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.882 0 C5'-C4'-O4' 112.953 2.22 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.596 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 C3'-C2'-C1' 100.978 -1.23 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.42 ' H2 ' ' P ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 110.035 -0.358 . . . . 10.0 110.035 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.45 165.12 11.99 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.412 ' OD1' ' HG2' ' A' ' 4' ' ' LYS . 13.3 t70 -67.34 -58.71 4.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.156 0.503 . . . . 10.0 110.152 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.412 ' HG2' ' OD1' ' A' ' 3' ' ' ASP . 37.3 mmtm -132.79 104.67 6.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.757 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.833 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 32.5 tp -76.39 141.18 41.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.774 0.321 . . . . 10.0 110.636 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -70.99 130.82 42.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.436 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.521 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 14.7 p90 -157.03 160.84 39.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.767 0.318 . . . . 10.0 110.934 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.474 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 8.7 tp10 -147.26 126.28 12.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.568 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.459 ' HA ' HG12 ' A' ' 30' ' ' VAL . 62.2 mt -82.69 106.12 13.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.15 0.5 . . . . 10.0 110.237 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.4 mm -76.49 -41.94 35.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.766 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -166.84 126.91 1.53 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.862 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -75.5 143.12 42.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 77.0 mt -110.01 -75.87 0.62 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.352 -0.539 . . . . 10.0 111.794 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.66 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.9 mm -128.49 137.34 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.53 . . . . 10.0 112.006 -177.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.411 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.5 p -119.83 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.095 -1.076 . . . . 10.0 108.095 177.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.539 HD22 ' HB ' ' B' ' 64' ' ' VAL . 32.0 mt -92.28 -80.92 0.35 Allowed 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.568 -0.453 . . . . 10.0 111.862 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 179.84 -168.72 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.527 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -110.34 147.76 33.29 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -83.27 -168.83 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.77 -21.45 65.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.548 0.69 . . . . 10.0 110.317 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -91.5 1.06 57.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.95 -1.023 . . . . 10.0 110.718 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.74 4.77 88.68 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.58 -0.819 . . . . 10.0 111.395 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.527 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.9 m0 -62.24 103.28 0.37 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.89 0.376 . . . . 10.0 110.994 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.533 ' O ' ' HA ' ' A' ' 43' ' ' THR . 11.3 tpp85 -83.8 100.69 11.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.571 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.564 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.0 mttt -83.4 115.12 21.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.066 0.46 . . . . 10.0 110.828 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.411 ' HG2' HG23 ' A' ' 15' ' ' VAL . 79.8 mt-10 -131.4 143.54 50.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.47 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.71 HD13 ' HB ' ' A' ' 41' ' ' ILE . 40.0 tp -112.43 108.29 17.39 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.157 -1.053 . . . . 10.0 108.157 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -131.54 160.64 34.66 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 10.0 111.213 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -97.11 113.73 25.33 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.501 -0.925 . . . . 10.0 108.501 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.459 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.5 m -127.46 157.0 39.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 120.928 0.394 . . . . 10.0 110.767 -179.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -95.95 125.81 40.76 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.176 178.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -64.62 110.21 2.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.959 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 60.66 27.53 17.25 Favored 'General case' 0 C--O 1.235 0.294 0 O-C-N 124.061 0.851 . . . . 10.0 110.624 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.6 t70 68.41 23.63 7.47 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.91 -1.041 . . . . 10.0 110.709 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.99 -84.67 0.54 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.102 -0.373 . . . . 10.0 111.666 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -91.63 123.27 64.05 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.516 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 62.8 Cg_endo -80.79 124.13 4.97 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.766 2.311 . . . . 10.0 111.808 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -143.08 170.03 16.47 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -96.1 126.57 41.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.684 0.278 . . . . 10.0 110.466 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.433 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -140.4 130.06 24.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.71 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.5 tt -106.55 124.32 61.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.354 0.597 . . . . 10.0 110.019 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.514 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.7 mtt85 -144.66 176.75 9.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.214 -177.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.564 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -123.63 142.11 51.36 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.796 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -117.58 170.66 8.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.932 -0.576 . . . . 10.0 109.616 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.11 159.08 73.59 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -57.81 -31.63 92.84 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.237 1.958 . . . . 10.0 111.773 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -91.57 -1.94 57.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.412 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 60.0 31.41 20.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.804 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -83.8 -33.14 25.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.165 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -135.74 174.88 10.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.366 0.603 . . . . 10.0 111.558 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.441 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -139.33 167.72 21.44 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.818 -1.083 . . . . 10.0 110.769 -177.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.651 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -135.11 -162.4 9.73 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.16 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -95.59 151.01 19.71 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.245 -0.562 . . . . 10.0 111.797 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -147.13 -125.43 1.61 Allowed Glycine 0 C--N 1.331 0.262 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.365 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.0 143.43 20.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 117.518 0.659 . . . . 10.0 111.259 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.432 ' HB ' ' H71' ' C' ' 7' ' ' ' DT' . 0.5 OUTLIER -105.92 140.06 39.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.572 179.732 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.4 mt -119.78 134.22 55.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.27 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.5 m -79.17 169.55 17.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.325 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -60.44 -49.8 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.707 0.262 . . . . 10.0 111.707 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -60.98 -43.47 98.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.548 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -61.03 -50.77 71.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.586 -0.733 . . . . 10.0 110.441 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.719 ' CE2' HD11 ' A' ' 66' ' ' LEU . 28.3 t80 -56.46 -45.84 80.66 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.239 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.89 -51.47 58.4 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.296 -0.478 . . . . 10.0 112.901 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.2 t -64.96 -42.69 95.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 10.0 110.664 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.7 tp -57.62 -51.83 67.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.807 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.719 HD11 ' CE2' ' A' ' 62' ' ' PHE . 21.8 mt -62.84 -45.47 92.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.47 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -52.65 -51.37 60.42 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.208 0.528 . . . . 10.0 111.246 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 9.6 mm-40 -71.41 -47.49 55.66 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.809 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.513 ' HB3' HD22 ' B' ' 66' ' ' LEU . 48.4 mt -58.4 -44.46 88.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.574 0.226 . . . . 10.0 111.604 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.9 -40.41 99.24 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.577 -0.82 . . . . 10.0 111.143 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -68.53 -26.54 65.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.326 . . . . 10.0 110.728 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 68.3 mmtt -69.66 -27.04 64.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.022 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.445 HD11 ' HB3' ' B' ' 66' ' ' LEU . 35.7 mt -82.37 -25.46 33.78 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.073 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.618 -0.706 . . . . 10.0 110.465 -179.713 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.419 ' H2 ' ' P ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.331 . . . . 10.0 110.223 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.36 171.33 8.64 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.439 ' OD1' ' HG2' ' B' ' 4' ' ' LYS . 13.1 t70 -74.22 -56.6 4.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.03 0.443 . . . . 10.0 110.059 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.439 ' HG2' ' OD1' ' B' ' 3' ' ' ASP . 41.9 mmtm -134.08 101.65 5.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.76 -0.654 . . . . 10.0 109.372 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.774 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 37.1 tp -74.56 137.79 42.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.151 -0.314 . . . . 10.0 110.151 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -70.33 128.56 36.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.785 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.61 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 15.3 p90 -153.5 163.35 40.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.392 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.463 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 11.5 tp10 -150.16 122.9 8.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.436 ' HA ' HG12 ' B' ' 30' ' ' VAL . 56.8 mt -79.07 109.9 14.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.144 0.497 . . . . 10.0 110.555 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.9 mm -79.13 -41.75 23.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.616 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -166.61 125.47 1.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.49 139.41 42.19 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 50.0 mt -108.46 -73.78 0.68 Allowed 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.385 -0.526 . . . . 10.0 112.294 -177.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.495 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.5 mm -128.01 132.22 68.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -177.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.414 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.8 p -115.77 122.37 69.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 177.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 38.1 mt -93.51 -80.83 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.754 -0.379 . . . . 10.0 111.84 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.8 m 178.94 -169.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.473 -0.565 . . . . 10.0 109.473 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -108.27 148.07 30.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.582 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -84.28 -171.92 3.88 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -18.69 65.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.383 0.611 . . . . 10.0 110.699 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . 0.434 ' HG2' ' C2 ' ' C' ' 11' ' ' ' DT' . 20.7 mttt -92.61 -3.32 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.606 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.82 4.13 76.03 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.418 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.514 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.2 m0 -62.06 104.01 0.43 Allowed 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.747 0.308 . . . . 10.0 111.02 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.5 tpp85 -84.45 100.75 11.53 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 179.098 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.629 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.4 mttt -82.25 116.24 21.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.016 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.414 ' HG2' HG23 ' B' ' 15' ' ' VAL . 62.0 mt-10 -132.56 141.3 48.65 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.744 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.689 HD13 ' HB ' ' B' ' 41' ' ' ILE . 40.8 tp -110.79 108.11 17.84 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -131.78 159.14 39.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.936 0.398 . . . . 10.0 111.385 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -94.8 113.58 25.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' B' ' 9' ' ' ILE . 14.7 m -126.88 157.79 37.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.884 0.373 . . . . 10.0 110.773 -179.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.1 p -97.26 125.5 41.86 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.32 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -64.53 110.4 2.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.932 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 59.24 30.09 19.77 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.504 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 34.0 t70 66.48 20.85 10.87 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.512 -1.222 . . . . 10.0 111.142 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.24 -87.4 0.45 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.803 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.607 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 30.8 tt0 -89.87 122.4 67.96 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-O 120.658 0.266 . . . . 10.0 111.64 -178.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 59.5 Cg_endo -79.47 125.24 6.18 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.86 2.374 . . . . 10.0 111.954 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.423 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 20.1 ttmm -144.12 169.88 17.01 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . 0.423 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 3.2 m-85 -97.24 125.45 41.81 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.441 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.9 t70 -139.77 129.32 24.33 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.689 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.4 tt -105.12 124.08 59.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.249 0.547 . . . . 10.0 110.044 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.519 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 2.7 mtt85 -144.29 175.62 9.95 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.346 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.629 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -122.21 142.0 50.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.048 179.698 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -117.73 169.75 9.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.452 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 158.83 73.67 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -56.08 -34.55 93.02 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.153 1.902 . . . . 10.0 111.602 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -88.38 -4.19 58.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.555 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.72 34.93 19.81 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.349 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.68 -34.82 21.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.723 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -134.04 174.34 10.59 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.268 0.556 . . . . 10.0 111.568 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.439 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -137.89 167.79 21.02 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.607 -1.179 . . . . 10.0 110.4 -178.196 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.654 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -135.0 -161.46 9.42 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.955 -0.64 . . . . 10.0 112.387 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -96.75 148.28 23.05 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.432 -0.452 . . . . 10.0 111.57 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.86 -124.5 1.81 Allowed Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 111.323 -0.711 . . . . 10.0 111.323 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -148.21 142.23 19.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 117.499 0.65 . . . . 10.0 111.129 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.4 HG22 ' HD2' ' B' ' 38' ' ' LYS . 0.7 OUTLIER -103.88 139.01 39.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.918 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 133.16 56.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.477 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.7 m -78.26 170.6 16.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.25 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.32 -52.58 64.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.294 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.579 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.9 pt-20 -58.97 -42.36 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.098 0.475 . . . . 10.0 110.641 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -62.4 -50.19 72.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.667 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.544 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.2 t80 -57.65 -43.19 84.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.586 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.69 -51.77 56.58 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.36 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.579 HG23 ' O ' ' B' ' 60' ' ' GLU . 35.5 t -62.57 -45.84 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.976 0.417 . . . . 10.0 110.422 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 16.6 tp -56.43 -53.29 59.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.373 -0.83 . . . . 10.0 110.721 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 32.4 mt -59.9 -48.8 80.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.249 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -52.2 -53.65 40.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.757 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.66 ' HB3' HD12 ' A' ' 14' ' ' ILE . 8.9 mm-40 -69.92 -48.53 58.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.973 -178.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.61 ' HB3' HD22 ' A' ' 66' ' ' LEU . 47.6 mt -59.12 -42.95 91.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.551 0.215 . . . . 10.0 111.418 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.12 -38.97 97.01 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.599 -0.81 . . . . 10.0 111.294 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . 0.448 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.9 t-20 -71.05 -27.46 63.66 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 10.0 110.915 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.0 mmtt -66.99 -26.03 66.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.367 -0.379 . . . . 10.0 111.553 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.525 HD11 ' CB ' ' A' ' 66' ' ' LEU . 23.1 mt -89.62 -13.6 36.75 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.546 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.448 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 42.9 mt-10 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.632 -0.699 . . . . 10.0 110.3 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 C3'-C2'-C1' 101.655 -0.747 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 101.494 -0.862 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.405 -1.131 0 O4'-C1'-C2' 104.127 -1.794 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.833 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.844 0 O4'-C4'-C3' 103.481 -2.119 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.514 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C4'-C3' 103.656 -1.944 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.825 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.533 0.829 0 C5'-C4'-O4' 112.88 2.175 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . 0.432 ' H71' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.427 -0.831 0 C3'-C2'-C1' 101.514 -0.847 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . 0.434 ' C2 ' ' HG2' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 C3'-C2'-C1' 101.624 -0.768 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.808 0 C3'-C2'-C1' 101.865 -0.596 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.938 0 O4'-C1'-C2' 104.357 -1.585 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.774 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 O4'-C4'-C3' 103.517 -2.083 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.519 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.885 0 O4'-C4'-C3' 103.864 -1.736 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.793 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.937 0 C5'-C4'-O4' 112.964 2.228 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.607 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 C3'-C2'-C1' 101.08 -1.157 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.7 mmm . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 120.916 0.389 . . . . 10.0 110.304 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.47 179.91 4.13 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.061 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -82.8 -60.73 2.08 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -131.13 94.64 3.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.068 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.764 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 27.7 tp -71.16 139.46 50.22 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.801 0.334 . . . . 10.0 110.272 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -71.75 137.46 47.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.957 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.6 p90 -161.44 172.15 16.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.934 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -155.44 138.13 15.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.436 ' HA ' HG12 ' A' ' 30' ' ' VAL . 54.8 mt -85.47 113.64 24.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.923 0.392 . . . . 10.0 110.335 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.07 -44.05 17.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.964 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -167.78 128.59 1.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.331 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -79.62 136.5 36.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.498 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 58.3 mt -106.99 -75.08 0.64 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.386 0.514 . . . . 10.0 112.386 -178.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.765 HD12 ' HB3' ' B' ' 68' ' ' GLU . 31.8 mm -127.07 140.93 47.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 112.596 0.591 . . . . 10.0 112.596 -177.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.454 HG23 ' HG2' ' A' ' 26' ' ' GLU . 5.1 p -121.2 123.22 69.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 108.31 -0.996 . . . . 10.0 108.31 177.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.416 HD22 ' HB ' ' B' ' 64' ' ' VAL . 31.1 mt -92.25 -81.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.542 -0.463 . . . . 10.0 111.572 -178.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -179.98 -174.8 0.28 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 122.748 0.419 . . . . 10.0 110.006 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.586 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 26.5 mp0 -111.12 156.81 20.81 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -102.99 -169.94 1.72 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.003 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.9 -23.43 67.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.391 0.615 . . . . 10.0 110.515 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -87.82 -4.66 58.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.511 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.03 3.56 87.61 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.759 -0.655 . . . . 10.0 112.063 -178.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.586 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 42.0 m0 -55.24 102.54 0.07 Allowed 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.373 0.269 . . . . 10.0 111.649 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.557 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.4 tpp85 -80.22 100.3 8.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.417 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 81.0 mttt -82.35 113.2 19.97 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.89 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.454 ' HG2' HG23 ' A' ' 15' ' ' VAL . 53.0 mt-10 -139.26 153.9 47.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.35 0.595 . . . . 10.0 111.743 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.741 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.5 tp -123.07 107.67 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.933 -1.03 . . . . 10.0 108.26 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -133.94 166.11 23.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.927 0.394 . . . . 10.0 110.88 -177.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.4 ttp180 -105.58 114.9 29.35 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.184 -0.673 . . . . 10.0 109.184 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.8 m -126.15 162.12 30.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.498 -179.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.427 ' HA ' ' O ' ' A' ' 36' ' ' GLU . 1.0 OUTLIER -99.29 123.12 43.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.948 0.404 . . . . 10.0 110.515 179.136 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.521 ' CH2' ' H72' ' C' ' 7' ' ' ' DT' . 14.7 m0 -64.73 112.86 3.42 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.837 -0.619 . . . . 10.0 109.619 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 59.7 26.1 15.16 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.806 0.692 . . . . 10.0 110.207 -178.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t0 63.52 28.48 15.29 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.614 -1.176 . . . . 10.0 110.96 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.69 -74.66 0.61 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.068 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' A' ' 31' ' ' SER . 45.7 tt0 -91.01 118.09 68.34 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.526 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -82.58 120.79 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.601 2.201 . . . . 10.0 110.667 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -150.06 163.07 39.11 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.796 -0.362 . . . . 10.0 110.771 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -83.47 139.48 32.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.538 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -151.05 130.61 13.01 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.741 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -108.83 123.7 64.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.238 0.542 . . . . 10.0 110.111 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.476 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.1 mtt85 -149.1 174.4 12.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.222 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.557 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 2.9 p -123.25 135.52 54.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.41 -0.959 . . . . 10.0 108.41 178.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 49.1 m0 -116.8 176.62 5.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.592 0.234 . . . . 10.0 110.693 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -66.86 153.64 93.71 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.406 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.41 -37.97 77.68 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.387 2.058 . . . . 10.0 111.561 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -83.76 -4.08 58.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.221 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 62.35 24.93 14.87 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.468 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -76.52 -31.73 57.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.973 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -140.07 174.13 10.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.33 0.586 . . . . 10.0 111.475 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.31 171.22 14.75 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.432 -178.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.504 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -138.15 -170.0 11.75 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.497 -0.859 . . . . 10.0 112.285 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -98.38 145.38 26.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 122.461 -0.435 . . . . 10.0 111.894 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.83 -111.87 0.85 Allowed Glycine 0 N--CA 1.453 -0.2 0 N-CA-C 110.952 -0.859 . . . . 10.0 110.952 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 tt -155.93 141.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 117.306 0.553 . . . . 10.0 110.803 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.2 m -98.44 141.67 31.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.139 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.3 mt -119.62 122.47 41.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.098 0.475 . . . . 10.0 110.543 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -80.93 168.34 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.578 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.13 -38.37 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.577 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.485 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -59.41 -47.84 83.92 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.388 178.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.485 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 29.5 mt-10 -66.96 -56.7 9.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.975 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.734 ' CE2' HD11 ' A' ' 66' ' ' LEU . 9.5 t80 -50.35 -45.84 55.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.437 -0.801 . . . . 10.0 111.956 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.1 -56.48 25.02 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.195 -0.526 . . . . 10.0 113.126 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.17 -43.53 91.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 10.0 111.14 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.0 tp -55.58 -51.61 66.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.973 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.751 HD22 ' HB3' ' B' ' 69' ' ' LEU . 20.5 mt -62.83 -45.47 92.45 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 121.002 -0.279 . . . . 10.0 111.121 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 ttpp -53.82 -52.63 59.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.89 -0.595 . . . . 10.0 111.005 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 15.8 mm-40 -69.69 -49.11 56.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.905 -178.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 39.9 mt -58.32 -44.78 88.81 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.624 0.25 . . . . 10.0 111.404 -179.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.24 -35.66 92.25 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.405 -0.902 . . . . 10.0 111.348 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -74.57 -18.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.867 0.365 . . . . 10.0 110.81 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 66.2 mmtt -75.19 -26.2 58.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.057 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' B' ' 66' ' ' LEU . 28.1 mt -90.1 -3.31 57.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.938 0.399 . . . . 10.0 110.565 179.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 118.481 -0.771 . . . . 10.0 110.336 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 90.3 mmm . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 120.878 0.37 . . . . 10.0 110.424 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.54 178.43 4.56 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.451 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -82.06 -58.25 3.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -131.79 94.04 3.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.226 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.702 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 27.4 tp -70.63 139.08 51.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.253 179.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -73.02 134.96 44.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 10.0 110.893 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.579 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 11.3 p90 -158.78 170.52 21.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.882 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.494 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.5 tp10 -153.08 134.35 14.22 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.41 ' HA ' HG12 ' B' ' 30' ' ' VAL . 52.2 mt -82.73 110.48 17.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.966 0.412 . . . . 10.0 110.413 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.4 mm -79.8 -48.61 20.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.635 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -164.96 129.46 2.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.229 -179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.93 144.51 36.78 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 57.8 mt -115.08 -70.75 0.78 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.231 -0.588 . . . . 10.0 112.433 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.551 HD12 ' HB3' ' A' ' 68' ' ' GLU . 15.3 mm -128.45 142.54 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.926 0.393 . . . . 10.0 111.847 -176.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.51 118.54 52.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.6 mt -88.23 -80.94 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -177.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.2 m 178.46 -172.24 0.13 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.596 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 24.0 mp0 -115.15 151.78 33.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.312 -0.403 . . . . 10.0 109.999 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . 0.401 ' HA ' HD22 ' B' ' 19' ' ' ASN . 3.3 m120 -96.82 -167.88 1.62 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -15.17 63.44 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.345 0.593 . . . . 10.0 110.601 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -94.41 -2.01 52.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.957 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.31 4.31 90.23 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.275 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.596 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.6 m0 -56.94 102.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.5 tpp85 -80.15 100.6 8.33 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.408 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 78.7 mttt -82.25 113.76 20.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.898 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -139.83 155.1 47.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.438 0.637 . . . . 10.0 111.747 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.717 HD13 ' HB ' ' B' ' 41' ' ' ILE . 37.3 tp -124.24 107.91 11.7 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.191 -1.04 . . . . 10.0 108.191 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -133.9 164.42 27.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.918 0.39 . . . . 10.0 110.927 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.1 ttp180 -104.13 114.3 28.44 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.4 m -125.25 162.1 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.748 -179.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.494 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.3 p -99.79 121.81 41.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.505 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . 0.539 ' CH2' ' H73' ' C' ' 17' ' ' ' DT' . 17.1 m0 -64.2 112.88 3.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.763 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 59.75 26.18 15.28 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.014 -178.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.0 t0 61.3 33.4 19.0 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 114.517 -1.22 . . . . 10.0 110.491 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.92 -70.05 0.81 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.064 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' B' ' 31' ' ' SER . 44.2 tt0 -94.92 117.58 66.83 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.574 -0.284 . . . . 10.0 111.601 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -81.64 120.16 3.47 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.372 2.048 . . . . 10.0 110.708 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 11.0 ttpt -150.24 163.23 38.81 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.804 -0.358 . . . . 10.0 110.708 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.88 138.51 32.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.347 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -150.04 130.5 13.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.717 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.2 tt -108.53 123.13 64.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.388 0.613 . . . . 10.0 110.14 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.57 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.9 mtt85 -149.03 175.47 11.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.574 -178.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.553 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 4.5 p -124.31 135.4 53.33 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -117.02 175.1 5.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.424 -0.213 . . . . 10.0 110.424 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.7 m -65.49 153.85 89.32 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.452 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.08 -34.97 89.07 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.424 2.083 . . . . 10.0 111.319 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.57 -4.75 59.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.049 -0.978 . . . . 10.0 110.23 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 61.98 23.81 14.08 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.783 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -76.7 -29.7 56.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -141.48 174.53 10.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.557 0.694 . . . . 10.0 111.953 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.15 171.8 13.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.598 -1.183 . . . . 10.0 110.32 -178.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.454 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -139.72 -170.64 12.01 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.238 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.9 mttp -97.57 141.61 30.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.256 0.55 . . . . 10.0 112.426 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -138.57 -119.32 1.72 Allowed Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.386 -1.086 . . . . 10.0 110.386 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -149.43 143.14 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 117.27 0.535 . . . . 10.0 110.674 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 4.0 m -97.81 139.57 33.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.524 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -117.75 119.29 34.46 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.967 0.413 . . . . 10.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -78.7 166.93 21.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.314 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.0 -35.17 74.46 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.874 0.368 . . . . 10.0 110.922 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.452 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 6.9 pt-20 -61.75 -46.07 91.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.062 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.452 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 31.3 mt-10 -68.34 -57.21 6.27 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.863 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.5 t80 -52.15 -42.28 63.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.463 -0.789 . . . . 10.0 111.478 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.99 -55.52 30.43 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 120.875 -0.678 . . . . 10.0 112.954 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.416 ' HB ' HD22 ' A' ' 16' ' ' LEU . 19.1 t -68.66 -42.36 83.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.937 0.399 . . . . 10.0 110.865 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.0 tp -56.59 -50.93 70.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.021 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' B' ' 62' ' ' PHE . 60.1 mt -60.62 -50.69 72.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.726 0.298 . . . . 10.0 110.606 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 24.8 tttm -50.84 -53.04 35.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.8 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.765 ' HB3' HD12 ' A' ' 14' ' ' ILE . 30.6 mm-40 -69.4 -52.45 26.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.282 -178.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.751 ' HB3' HD22 ' A' ' 66' ' ' LEU . 62.4 mt -58.87 -43.13 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.91 -38.23 96.22 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.47 -0.872 . . . . 10.0 111.142 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . 0.408 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.4 t-20 -73.51 -20.06 60.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.504 -0.348 . . . . 10.0 111.359 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.8 mmtt -72.64 -27.51 62.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.658 0.266 . . . . 10.0 110.95 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.88 0.46 57.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.984 0.421 . . . . 10.0 111.019 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.408 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 38.9 mt-10 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.789 -0.624 . . . . 10.0 109.892 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 101.73 -0.693 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.533 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 101.315 -0.989 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . 0.533 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.889 0 O4'-C1'-C2' 104.053 -1.861 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.764 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.855 0 O4'-C4'-C3' 103.567 -2.033 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.476 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 O4'-C4'-C3' 103.521 -2.079 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.781 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.787 0 C5'-C4'-O4' 113.084 2.302 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . 0.521 ' H72' ' CH2' ' A' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.423 -1.04 0 C3'-C2'-C1' 101.179 -1.086 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.797 0 C3'-C2'-C1' 101.394 -0.933 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . 0.509 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.901 0 C3'-C2'-C1' 101.913 -0.562 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.509 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.83 0 O4'-C1'-C2' 104.36 -1.582 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.702 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.519 -0.9 0 O4'-C4'-C3' 103.599 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.57 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.976 0 O4'-C4'-C3' 103.714 -1.886 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.798 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.831 0 C5'-C4'-O4' 113.154 2.346 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.539 ' H73' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 C3'-C2'-C1' 100.971 -1.235 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.756 0.312 . . . . 10.0 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.46 160.23 17.98 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -66.96 -53.4 32.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.236 -0.653 . . . . 10.0 109.236 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -139.98 95.23 2.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.195 -0.911 . . . . 10.0 109.697 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.735 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.5 tp -64.22 145.77 55.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.852 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.1 tppt? -79.25 136.48 37.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.47 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -164.32 163.53 22.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.189 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.458 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.8 tp10 -145.4 126.09 14.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.533 ' HA ' HG12 ' A' ' 30' ' ' VAL . 84.6 mt -73.83 110.77 8.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.002 0.429 . . . . 10.0 110.147 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mm -80.68 -48.89 19.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -162.96 126.65 2.88 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.042 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -78.39 144.31 36.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 68.7 mt -112.44 -75.46 0.61 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.565 -0.454 . . . . 10.0 111.625 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.566 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.0 mm -128.87 140.35 49.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.304 0.573 . . . . 10.0 112.49 -177.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.452 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.4 p -123.59 120.45 60.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 107.85 -1.167 . . . . 10.0 107.85 177.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.601 HD22 ' HB ' ' B' ' 64' ' ' VAL . 32.5 mt -89.72 -81.68 0.28 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.567 -0.453 . . . . 10.0 112.124 -177.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.2 m -174.51 -168.39 0.37 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -107.44 136.57 47.01 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.827 -0.435 . . . . 10.0 109.827 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -74.43 -173.83 1.85 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.793 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.06 68.45 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.614 0.721 . . . . 10.0 110.574 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -88.66 -1.07 57.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.811 -1.086 . . . . 10.0 110.91 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.36 1.62 81.01 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.125 -0.79 . . . . 10.0 111.125 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -59.06 106.05 0.38 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.838 0.351 . . . . 10.0 111.318 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.523 ' O ' ' HA ' ' A' ' 43' ' ' THR . 7.4 tpp85 -84.53 99.74 10.93 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.504 178.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.445 ' HG2' HG22 ' A' ' 43' ' ' THR . 93.3 mttt -82.91 118.29 23.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.425 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.452 ' HG2' HG23 ' A' ' 15' ' ' VAL . 62.6 mt-10 -133.56 149.79 51.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.986 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 40.3 tp -117.76 108.11 14.97 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.612 -0.884 . . . . 10.0 108.612 178.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -135.63 160.97 36.85 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.791 0.329 . . . . 10.0 110.451 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 ttp180 -102.19 115.0 29.63 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.533 HG12 ' HA ' ' A' ' 9' ' ' ILE . 14.2 m -125.26 161.85 28.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.691 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.458 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 2.4 p -93.39 124.52 37.44 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -63.66 108.28 1.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.443 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 61.8 m-80 59.28 30.36 20.08 Favored 'General case' 0 CA--C 1.522 -0.108 0 O-C-N 123.869 0.73 . . . . 10.0 109.703 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 44.1 t0 62.91 26.69 15.67 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.365 -1.289 . . . . 10.0 111.09 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -114.26 -71.2 0.76 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.128 -0.357 . . . . 10.0 111.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -94.16 114.79 64.13 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.853 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 53.5 Cg_endo -78.27 119.9 4.74 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.164 1.909 . . . . 10.0 110.282 177.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.434 ' HE3' HG21 ' A' ' 56' ' ' THR . 20.7 ttpt -150.03 166.23 30.33 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.889 -0.324 . . . . 10.0 110.489 -178.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -87.01 132.16 33.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 10.0 110.867 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.415 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -144.8 132.96 21.57 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.49 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -109.88 121.83 63.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.356 0.598 . . . . 10.0 109.824 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.506 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtt85 -144.74 179.44 7.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.281 -177.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -128.05 146.01 50.81 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.197 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -117.23 178.16 4.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.938 -0.573 . . . . 10.0 109.783 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.404 ' HG ' ' H ' ' A' ' 50' ' ' LYS . 1.3 p -80.36 161.41 64.97 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -57.63 -29.78 86.46 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.368 2.045 . . . . 10.0 112.612 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -100.5 0.16 39.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.135 0.493 . . . . 10.0 110.323 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 59.14 34.19 23.16 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.219 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.14 -37.22 22.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.102 0.477 . . . . 10.0 110.327 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.404 ' H ' ' HG ' ' A' ' 45' ' ' SER . 43.5 mmtm -139.35 174.38 10.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.912 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.422 ' N ' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -150.55 173.04 14.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.758 -177.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.6 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -133.42 -162.08 9.99 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.779 -0.724 . . . . 10.0 112.212 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -90.08 162.5 15.29 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.361 -0.493 . . . . 10.0 112.243 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -152.78 -121.63 0.89 Allowed Glycine 0 C--N 1.33 0.229 0 CA-C-N 115.248 -0.887 . . . . 10.0 111.277 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.2 tt -153.66 143.17 14.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 117.48 0.64 . . . . 10.0 110.969 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.434 HG21 ' HE3' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -105.01 145.73 30.03 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.955 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -125.94 132.11 52.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.007 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -75.36 161.61 29.12 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -57.12 -46.23 82.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.559 -179.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.49 -46.13 91.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.944 0.402 . . . . 10.0 110.585 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -59.52 -49.59 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.355 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.738 ' CE2' HD11 ' A' ' 66' ' ' LEU . 15.6 t80 -57.07 -43.84 82.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.22 -0.9 . . . . 10.0 111.356 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.43 -56.3 25.99 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.717 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.87 -41.28 88.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.912 0.387 . . . . 10.0 110.373 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.445 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 17.4 tp -58.2 -54.6 45.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.872 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.738 HD11 ' CE2' ' A' ' 62' ' ' PHE . 22.2 mt -62.44 -46.29 89.19 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.757 -0.201 . . . . 10.0 111.465 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 tttm -50.4 -49.98 53.03 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.603 0.564 . . . . 10.0 111.459 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 13.3 mm-40 -72.35 -48.67 40.11 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.414 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.475 ' HB3' HD22 ' B' ' 66' ' ' LEU . 84.1 mt -57.41 -44.98 85.04 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.05 98.75 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.686 -0.769 . . . . 10.0 111.372 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.469 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 13.1 t-20 -68.06 -28.31 67.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.955 0.407 . . . . 10.0 111.057 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 73.6 mmtt -67.41 -28.9 68.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.087 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.644 HD11 ' HB3' ' B' ' 66' ' ' LEU . 50.5 mt -89.68 -4.86 57.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.682 -0.236 . . . . 10.0 111.126 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 41.1 mt-10 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.42 -0.8 . . . . 10.0 110.722 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.865 0.364 . . . . 10.0 110.406 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.4 161.78 13.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.2 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.01 -51.81 29.3 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -139.98 94.51 2.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.212 -0.904 . . . . 10.0 109.313 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.711 HD13 H5'' ' C' ' 15' ' ' ' DT' . 25.3 tp -62.35 145.12 54.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.121 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -79.43 134.08 36.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.658 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.563 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 7.4 p90 -163.44 161.71 24.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.449 179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -142.38 130.22 21.7 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.45 ' HA ' HG12 ' B' ' 30' ' ' VAL . 65.5 mt -78.26 105.91 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.939 0.4 . . . . 10.0 110.802 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 40.8 mm -75.99 -47.42 32.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.619 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -164.04 127.33 2.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.08 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -79.67 141.72 36.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.5 mt -112.09 -72.98 0.69 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.381 -0.528 . . . . 10.0 112.354 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.501 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.6 mm -127.81 140.39 49.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.107 0.48 . . . . 10.0 112.074 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 p -125.26 115.47 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.0 mt -84.94 -82.19 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.207 0.447 . . . . 10.0 112.207 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.0 m -177.42 -167.9 0.17 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -107.03 138.25 43.55 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -76.93 -172.67 2.4 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.868 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.87 -13.92 62.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.41 0.624 . . . . 10.0 111.417 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -101.14 2.27 40.02 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.885 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 2.22 85.2 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.269 -178.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 41.1 m0 -59.93 106.06 0.46 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.975 0.417 . . . . 10.0 111.484 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.511 ' O ' ' HA ' ' B' ' 43' ' ' THR . 8.1 tpp85 -84.57 100.03 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.646 178.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -82.53 118.73 23.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.908 0.385 . . . . 10.0 110.486 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -133.54 148.32 51.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.93 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.553 HD13 ' HB ' ' B' ' 41' ' ' ILE . 41.4 tp -118.03 107.74 14.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.412 -0.959 . . . . 10.0 108.412 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -135.99 162.5 32.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.893 0.377 . . . . 10.0 110.743 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -103.2 114.83 29.44 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.4 m -123.85 162.2 25.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.46 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 2.1 p -93.91 123.41 37.25 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.865 -0.421 . . . . 10.0 109.865 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -63.21 108.01 1.18 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 62.7 m-80 60.05 29.26 18.84 Favored 'General case' 0 CA--C 1.523 -0.082 0 O-C-N 123.707 0.629 . . . . 10.0 109.773 -177.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t0 61.27 34.57 18.56 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.7 -1.136 . . . . 10.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -123.09 -71.61 0.72 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.083 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -91.77 114.58 62.41 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.385 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.411 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 39.3 Cg_endo -80.64 118.7 3.54 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.773 1.649 . . . . 10.0 109.964 178.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -148.23 166.62 27.39 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 110.217 -0.29 . . . . 10.0 110.217 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -87.56 132.79 33.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.583 -0.281 . . . . 10.0 110.666 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -145.57 132.07 19.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.99 -0.744 . . . . 10.0 108.99 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.553 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.3 tt -108.94 121.65 62.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.442 0.639 . . . . 10.0 109.915 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.447 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.2 mtt85 -144.11 179.88 6.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.307 -178.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.1 OUTLIER -128.86 146.3 50.97 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.402 -179.762 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -117.56 176.66 5.07 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.941 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -77.64 161.15 72.94 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.211 -0.662 . . . . 10.0 109.211 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.41 -30.25 87.31 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.268 1.979 . . . . 10.0 112.16 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -97.14 -4.98 38.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.74 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 64.01 29.83 14.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.558 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -82.35 -37.31 25.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.111 0.481 . . . . 10.0 110.293 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -137.54 171.77 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.984 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.405 ' SD ' ' N ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -148.82 173.13 13.6 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.577 -178.068 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.644 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -132.86 -158.45 8.84 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.849 -0.691 . . . . 10.0 112.271 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -92.64 160.63 14.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.16 0.505 . . . . 10.0 112.307 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.405 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -152.31 -127.95 1.33 Allowed Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 110.654 -0.979 . . . . 10.0 110.654 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.5 tt -147.98 143.32 19.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 117.511 0.656 . . . . 10.0 111.24 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -103.67 145.02 30.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.685 -0.688 . . . . 10.0 111.132 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 81.5 mt -125.8 131.63 52.42 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.266 -0.424 . . . . 10.0 109.99 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -75.29 161.33 29.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.17 -47.0 82.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.702 0.287 . . . . 10.0 111.657 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.477 ' O ' HG23 ' B' ' 64' ' ' VAL . 12.1 pt-20 -62.17 -42.16 99.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.987 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -63.12 -48.72 77.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.868 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.528 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.1 t80 -59.29 -40.19 85.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.756 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.28 -56.06 27.3 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.176 -0.535 . . . . 10.0 112.625 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.601 ' HB ' HD22 ' A' ' 16' ' ' LEU . 8.1 t -62.16 -41.69 92.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.001 0.429 . . . . 10.0 110.486 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.3 tp -58.03 -54.48 46.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.048 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.644 ' HB3' HD11 ' A' ' 73' ' ' LEU . 51.1 mt -61.31 -48.45 81.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.577 -0.283 . . . . 10.0 111.219 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -49.57 -52.71 28.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.844 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' B' ' 72' ' ' LYS . 8.0 mm-40 -71.31 -48.22 51.9 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.958 -178.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.592 ' HB3' HD22 ' A' ' 66' ' ' LEU . 60.5 mt -58.57 -45.24 89.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.71 -0.223 . . . . 10.0 111.56 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.64 96.24 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.685 -0.769 . . . . 10.0 111.358 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . 0.553 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 13.6 t-20 -70.9 -26.61 63.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.931 0.396 . . . . 10.0 111.149 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 73.3 mmtt -68.28 -27.21 66.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.272 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.592 HD11 ' CB ' ' A' ' 66' ' ' LEU . 22.5 mt -90.9 -2.35 57.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.974 -0.29 . . . . 10.0 111.446 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.553 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 41.4 mt-10 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.606 -0.711 . . . . 10.0 110.038 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.561 0 C3'-C2'-C1' 101.618 -0.773 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.938 0 C3'-C2'-C1' 101.343 -0.969 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.91 0 O4'-C1'-C2' 104.187 -1.739 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.735 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 O4'-C4'-C3' 103.644 -1.956 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.637 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 O4'-C4'-C3' 103.521 -2.079 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.853 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.434 1.069 0 C5'-C4'-O4' 113.166 2.354 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.803 0 C3'-C2'-C1' 101.172 -1.091 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 101.626 -0.767 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . 0.476 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 101.793 -0.648 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.476 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.897 0 O4'-C1'-C2' 104.436 -1.513 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.749 ' OP1' " H4'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 O4'-C4'-C3' 103.507 -2.093 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.711 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 C4'-C3'-C2' 101.503 -1.697 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.847 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.863 0 C5'-C4'-O4' 113.032 2.27 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.953 0 C3'-C2'-C1' 100.954 -1.247 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.894 0.378 . . . . 10.0 110.572 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.78 161.83 16.47 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.85 -58.74 5.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.986 0.422 . . . . 10.0 110.291 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -135.12 93.48 3.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.004 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.697 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 24.0 tp -64.78 141.16 58.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -74.25 132.39 42.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.741 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.402 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 9.0 p90 -156.77 166.19 34.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.958 179.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.435 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.7 tp10 -154.56 129.39 9.39 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -78.11 114.68 19.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.106 0.479 . . . . 10.0 110.147 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.7 mm -85.28 -41.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.171 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -169.42 127.73 0.97 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.685 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -75.28 143.94 42.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 85.2 mt -114.78 -73.7 0.64 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.349 -0.541 . . . . 10.0 111.626 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.671 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.7 mm -129.19 143.85 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 10.0 112.315 -177.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.428 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.7 p -128.24 123.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 108.205 -1.035 . . . . 10.0 108.205 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.588 HD22 ' HB ' ' B' ' 64' ' ' VAL . 35.4 mt -91.49 -81.37 0.33 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.263 -0.575 . . . . 10.0 111.5 -178.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -177.27 -171.87 0.36 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -104.1 133.46 49.01 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -73.5 -173.72 1.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.684 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.86 -30.63 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.72 0.771 . . . . 10.0 110.31 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -83.64 -2.14 55.48 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.544 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.02 2.28 81.08 Favored Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.406 -0.902 . . . . 10.0 110.947 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 40.9 m0 -60.03 105.57 0.41 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.981 0.42 . . . . 10.0 111.191 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.3 tpp85 -82.77 100.11 10.08 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.492 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.573 ' HG2' HG22 ' A' ' 43' ' ' THR . 86.9 mttt -80.92 115.09 20.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.435 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.428 ' HG2' HG23 ' A' ' 15' ' ' VAL . 60.9 mt-10 -133.09 154.25 50.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.998 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' HB ' ' A' ' 41' ' ' ILE . 36.1 tp -125.42 107.96 11.18 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -134.9 156.72 48.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.804 0.335 . . . . 10.0 110.899 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 29' ' ' ARG . 37.6 ttm180 -90.76 114.72 27.16 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.03 -0.73 . . . . 10.0 109.03 178.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.7 m -126.03 156.54 36.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.805 0.336 . . . . 10.0 110.763 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.8 p -94.45 122.94 37.54 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.933 0.397 . . . . 10.0 110.565 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -64.42 109.47 1.95 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.049 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.0 m-80 60.33 31.04 20.29 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.67 -0.696 . . . . 10.0 110.151 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.19 17.05 10.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.548 -1.205 . . . . 10.0 111.222 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.07 -97.79 0.28 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.446 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.78 124.48 85.04 Favored Pre-proline 0 C--O 1.234 0.247 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -178.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 72.9 Cg_endo -80.09 123.78 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.832 2.355 . . . . 10.0 111.456 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -142.27 167.23 22.59 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.738 -0.385 . . . . 10.0 110.169 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -92.36 128.74 38.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.127 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.443 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.7 t70 -141.69 130.45 22.89 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.64 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.4 tt -106.45 122.33 60.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 110.03 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.524 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.7 mtt85 -144.87 -178.35 5.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.105 -177.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.573 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -127.68 142.4 51.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.817 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -117.47 175.06 5.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 10.0 109.783 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.53 159.67 71.53 Favored Pre-proline 0 C--N 1.32 -0.703 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -59.58 -28.38 87.28 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.347 2.032 . . . . 10.0 111.981 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -93.43 -5.51 49.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.126 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.12 31.61 21.43 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.563 -179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 50' ' ' LYS . 13.5 pt-20 -81.74 -40.0 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.531 -0.759 . . . . 10.0 110.927 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.418 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 44.8 mmtm -140.24 173.64 11.31 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.82 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.471 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -148.38 172.23 14.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.708 -177.755 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.643 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -130.51 -154.65 8.05 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.708 -0.758 . . . . 10.0 112.232 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -100.46 155.23 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.253 -0.557 . . . . 10.0 112.221 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -146.6 -120.27 1.23 Allowed Glycine 0 CA--C 1.518 0.246 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.921 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.3 tt -150.52 142.66 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 117.564 0.682 . . . . 10.0 111.275 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.28 146.01 29.41 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.771 -0.65 . . . . 10.0 111.011 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.7 mt -131.55 127.18 36.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 m -80.26 171.61 14.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.699 0.285 . . . . 10.0 111.194 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -52.16 -59.43 4.38 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -59.52 -45.58 91.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.622 0.249 . . . . 10.0 111.641 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -59.86 -50.18 74.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 10.0 110.7 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.681 ' CE2' HD11 ' A' ' 66' ' ' LEU . 39.9 t80 -62.18 -41.68 98.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.397 -0.819 . . . . 10.0 111.215 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.77 57.22 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 116.069 -0.514 . . . . 10.0 112.913 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.43 -41.68 93.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.903 0.383 . . . . 10.0 110.226 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.522 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 21.8 tp -57.31 -52.27 66.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.45 179.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.681 HD11 ' CE2' ' A' ' 62' ' ' PHE . 18.1 mt -62.38 -45.21 94.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.733 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -51.99 -50.13 61.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.172 -179.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 5.5 mm-40 -72.71 -46.31 54.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.664 -179.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 60.9 mt -58.34 -45.34 88.3 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.8 0.333 . . . . 10.0 111.575 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.38 -39.86 98.24 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 111.166 -0.774 . . . . 10.0 111.166 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 18.0 t-20 -67.22 -29.82 69.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.994 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.4 mmtt -68.12 -27.3 66.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.735 0.302 . . . . 10.0 110.731 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.586 HD11 ' HB3' ' B' ' 66' ' ' LEU . 25.5 mt -89.47 -8.45 52.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.039 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.457 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 33.4 mt-10 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.62 -0.705 . . . . 10.0 110.029 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 CA-C-O 120.918 0.389 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.49 165.17 11.33 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.757 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -69.06 -58.95 3.41 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -133.42 94.71 3.36 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.667 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 28.7 tp -65.93 140.94 58.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.25 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -75.28 131.14 40.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.398 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.524 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 7.9 p90 -154.5 168.47 26.61 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.266 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.476 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 8.6 tp10 -155.86 128.2 7.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.8 mt -78.13 110.83 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.492 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 25.7 mm -80.92 -42.46 20.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.479 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -169.34 126.85 0.94 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.434 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -74.84 144.41 43.46 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 68.0 mt -115.8 -72.85 0.67 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.447 -0.501 . . . . 10.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.565 HD12 ' CB ' ' A' ' 68' ' ' GLU . 22.4 mm -127.86 142.93 42.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.281 0.562 . . . . 10.0 112.144 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.438 HG23 ' HG2' ' B' ' 26' ' ' GLU . 3.6 p -126.8 126.38 68.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 107.801 -1.185 . . . . 10.0 107.801 177.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 52.2 mt -93.91 -81.56 0.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.311 -0.556 . . . . 10.0 111.687 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -178.27 -172.31 0.3 Allowed 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.435 -0.579 . . . . 10.0 109.435 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -104.46 129.35 52.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -70.59 -174.92 0.95 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.998 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.83 -27.9 69.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.356 0.598 . . . . 10.0 110.841 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -88.42 0.7 55.95 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.78 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.36 2.04 83.2 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.117 -0.793 . . . . 10.0 111.117 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . . . . . . . . . 40.5 m0 -60.0 105.51 0.4 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.001 0.429 . . . . 10.0 111.445 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.502 ' O ' ' HA ' ' B' ' 43' ' ' THR . 11.7 tpp85 -81.7 100.8 9.68 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.769 178.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.587 ' HG2' HG22 ' B' ' 43' ' ' THR . 82.2 mttt -81.08 116.85 21.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.625 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.438 ' HG2' HG23 ' B' ' 15' ' ' VAL . 62.9 mt-10 -135.31 152.87 51.9 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.978 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.688 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.4 tp -125.34 108.05 11.3 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -134.84 156.0 49.67 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.112 -177.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.43 ' HD2' HH11 ' B' ' 29' ' ' ARG . 39.5 ttm180 -89.59 114.57 26.18 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 m -125.78 156.41 35.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.775 0.321 . . . . 10.0 110.455 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.476 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 1.0 OUTLIER -94.09 124.28 38.01 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.362 179.184 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -65.16 109.66 2.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 10.0 109.934 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 60.93 30.98 19.95 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.151 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 66.36 22.07 10.85 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.801 -1.09 . . . . 10.0 110.778 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.08 -96.86 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.419 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.54 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 39.9 tt0 -78.66 122.85 85.35 Favored Pre-proline 0 C--O 1.234 0.24 0 CA-C-O 120.845 0.355 . . . . 10.0 111.854 -178.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.7 Cg_endo -79.66 124.02 5.56 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.913 2.409 . . . . 10.0 111.255 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -143.45 169.03 18.45 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.02 -0.363 . . . . 10.0 110.02 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.29 128.97 41.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.429 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t70 -141.69 129.33 21.53 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.688 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.6 tt -105.23 122.81 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 10.0 110.084 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.524 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.0 mtt85 -145.04 -178.6 6.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.804 -0.634 . . . . 10.0 111.239 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.587 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -128.09 142.67 51.14 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 109.942 179.561 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -117.6 174.15 6.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.837 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.83 159.55 76.11 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.95 -26.6 82.81 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.332 2.021 . . . . 10.0 111.954 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -95.12 -5.52 43.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.037 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 59.84 31.35 20.72 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.538 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.444 ' HG3' ' N ' ' B' ' 50' ' ' LYS . 11.5 pt-20 -81.49 -39.76 24.28 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.893 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . 0.444 ' N ' ' HG3' ' B' ' 49' ' ' GLU . 39.1 mmtm -139.43 173.05 11.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.808 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.469 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -146.78 172.38 13.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.524 -177.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.62 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -131.17 -154.69 7.94 Favored Glycine 0 C--O 1.228 -0.278 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.34 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . 0.403 ' HA ' ' NH2' ' B' ' 42' ' ' ARG . 42.1 mttp -101.08 150.49 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 122.298 -0.531 . . . . 10.0 112.264 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -141.51 -123.14 1.88 Allowed Glycine 0 C--N 1.332 0.311 0 N-CA-C 110.595 -1.002 . . . . 10.0 110.595 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.0 tt -147.93 142.59 19.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 117.653 0.726 . . . . 10.0 111.065 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 140.76 37.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.338 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 52.4 mt -126.2 126.79 44.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.095 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m -78.68 173.86 12.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.831 0.348 . . . . 10.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -57.16 -56.73 18.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.105 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.562 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.7 pt-20 -61.16 -44.17 97.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.651 0.262 . . . . 10.0 111.494 -179.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -62.77 -48.05 80.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.015 0.436 . . . . 10.0 110.749 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -64.64 -38.58 91.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.436 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.84 -53.66 44.42 Favored Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.117 -0.492 . . . . 10.0 112.549 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.588 ' HB ' HD22 ' A' ' 16' ' ' LEU . 20.5 t -61.42 -43.33 96.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 10.0 110.047 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 17.4 tp -57.26 -52.48 65.15 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.615 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.586 ' HB3' HD11 ' A' ' 73' ' ' LEU . 80.9 mt -59.32 -51.51 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.18 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 39.1 tttm -48.52 -52.09 24.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.873 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.671 ' HB3' HD12 ' A' ' 14' ' ' ILE . 14.5 mm-40 -71.15 -48.12 53.78 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.951 -178.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.681 ' HB3' HD22 ' A' ' 66' ' ' LEU . 55.9 mt -58.89 -44.55 91.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.98 -41.11 99.64 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.924 -0.87 . . . . 10.0 110.924 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 12.0 t-20 -67.08 -30.0 69.92 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.909 0.385 . . . . 10.0 111.258 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.604 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 74.7 mmtt -65.13 -31.34 72.48 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.312 -0.242 . . . . 10.0 111.146 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.536 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.5 mt -90.12 -5.85 56.06 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.718 -0.393 . . . . 10.0 111.642 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.457 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 28.1 mt-10 . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.622 -0.704 . . . . 10.0 110.47 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.513 -0.574 0 C3'-C2'-C1' 101.425 -0.91 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.5 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 C3'-C2'-C1' 101.538 -0.83 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . 0.5 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.887 0 O4'-C1'-C2' 104.143 -1.779 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.697 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O4'--C1' 1.429 0.718 0 O4'-C4'-C3' 103.58 -2.02 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.524 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.904 0 O4'-C4'-C3' 103.52 -2.08 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.854 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.776 0 C5'-C4'-O4' 113.145 2.34 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.907 0 C3'-C2'-C1' 101.302 -0.998 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.914 0 C3'-C2'-C1' 101.45 -0.893 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.844 0 C5'-C4'-O4' 108.567 -0.52 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.451 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C1'-C2' 104.277 -1.657 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.667 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.835 0 O4'-C4'-C3' 103.585 -2.015 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.524 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 O4'-C4'-C3' 103.752 -1.848 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.797 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.953 0 C5'-C4'-O4' 113.036 2.273 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.54 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.424 -0.978 0 C3'-C2'-C1' 100.969 -1.236 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.941 0.4 . . . . 10.0 110.177 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.76 162.53 13.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.9 -53.0 14.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -133.93 94.8 3.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.006 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.802 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 21.9 tp -67.73 144.4 55.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.605 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.1 tppt? -77.58 133.4 38.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.701 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -161.1 172.91 15.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.479 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.6 133.96 11.65 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.42 ' HA ' HG12 ' A' ' 30' ' ' VAL . 65.1 mt -83.8 107.9 15.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 120.985 0.421 . . . . 10.0 110.031 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.2 mm -76.0 -45.85 35.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -165.23 131.18 2.7 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.632 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.21 144.63 34.22 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 83.1 mt -113.7 -74.63 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.279 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.681 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.0 mm -132.1 139.15 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.246 0.546 . . . . 10.0 112.171 -177.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -120.17 122.21 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.851 -1.166 . . . . 10.0 107.851 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.489 HD22 ' HB ' ' B' ' 64' ' ' VAL . 26.0 mt -89.03 -80.67 0.29 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.533 -0.467 . . . . 10.0 111.917 -177.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 m 179.2 -169.41 0.1 Allowed 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.414 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 32.9 mp0 -106.45 146.27 30.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.263 179.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -87.86 -170.39 2.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.589 -0.522 . . . . 10.0 109.589 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.27 -24.56 67.7 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.532 0.682 . . . . 10.0 110.71 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HD3' H2'' ' C' ' 1' ' ' ' DT' . 31.1 mttt -93.9 3.28 55.61 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.061 -0.972 . . . . 10.0 110.757 -179.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.75 8.08 86.47 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.8 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.414 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.8 m0 -60.82 103.97 0.31 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.755 0.312 . . . . 10.0 111.5 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.513 ' O ' ' HA ' ' A' ' 43' ' ' THR . 12.1 tpp85 -81.58 99.26 8.74 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.469 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.6 mttt -85.37 117.82 24.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.918 0.39 . . . . 10.0 110.612 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG2' HG23 ' A' ' 15' ' ' VAL . 48.6 mt-10 -135.12 153.71 51.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.529 -0.759 . . . . 10.0 111.123 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.544 HD13 ' HB ' ' A' ' 41' ' ' ILE . 34.9 tp -123.16 107.23 11.5 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.009 -1.108 . . . . 10.0 108.009 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -135.79 154.96 51.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.315 -178.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -91.24 115.05 27.71 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 9' ' ' ILE . 13.5 m -123.85 160.43 27.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.696 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.479 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -97.29 122.83 40.77 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.349 179.059 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 6.5 m0 -63.64 110.97 2.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.898 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.457 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 58.36 30.29 19.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.41 0.624 . . . . 10.0 110.18 -178.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.9 t70 62.53 29.64 17.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.802 -1.09 . . . . 10.0 111.028 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.7 -74.98 0.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 O-C-N 122.103 -0.373 . . . . 10.0 111.49 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.51 112.69 50.04 Favored Pre-proline 0 C--N 1.328 -0.357 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.422 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.8 Cg_endo -80.45 120.18 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.392 2.061 . . . . 10.0 110.714 178.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.0 ttpt -152.35 172.22 16.8 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.843 -0.343 . . . . 10.0 110.482 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -91.06 134.94 34.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.675 0.274 . . . . 10.0 111.262 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -146.88 130.45 16.85 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.544 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.6 tt -107.14 123.45 62.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.283 0.563 . . . . 10.0 110.194 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.464 HH21 H2'' ' C' ' 4' ' ' ' DT' . 3.1 mtt85 -146.32 179.28 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.34 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.513 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -126.82 145.11 50.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.147 179.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -117.4 173.5 6.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.457 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -76.69 156.57 82.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.17 -33.08 95.24 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.396 2.064 . . . . 10.0 112.943 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -97.27 2.85 51.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.811 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 56.99 41.68 27.31 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.266 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.78 -37.21 14.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.622 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -142.21 174.36 10.68 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.019 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.461 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -136.68 172.43 13.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.458 -0.792 . . . . 10.0 111.234 -177.614 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.631 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -134.74 -165.89 10.98 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 121.182 -0.533 . . . . 10.0 111.917 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.6 mttp -94.53 156.16 16.58 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.024 -0.692 . . . . 10.0 111.988 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.4 ' HA3' ' HG2' ' A' ' 42' ' ' ARG . . . -150.67 -130.76 1.76 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.017 -0.833 . . . . 10.0 111.017 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 tt -144.23 143.72 23.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 117.723 0.761 . . . . 10.0 111.44 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.73 144.2 31.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.966 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -125.01 131.53 53.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.379 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.94 162.92 25.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.553 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.9 -51.7 66.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -178.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.06 -44.68 97.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.777 0.323 . . . . 10.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.452 ' HB3' HD13 ' B' ' 16' ' ' LEU . 79.8 mt-10 -62.19 -45.72 92.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.448 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.685 ' CE2' HD11 ' A' ' 66' ' ' LEU . 29.2 t80 -61.39 -42.61 99.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.019 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.48 -53.76 43.46 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.394 -0.432 . . . . 10.0 112.457 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.5 t -59.97 -41.63 86.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.986 0.422 . . . . 10.0 110.262 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 18.1 tp -59.97 -53.98 51.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.713 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.685 HD11 ' CE2' ' A' ' 62' ' ' PHE . 17.3 mt -60.89 -46.88 88.88 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.637 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.6 tttm -49.93 -55.28 15.06 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.735 0.647 . . . . 10.0 111.43 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.493 ' CB ' HD12 ' B' ' 14' ' ' ILE . 26.2 mm-40 -68.9 -45.45 70.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.736 -0.666 . . . . 10.0 111.788 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 67.4 mt -59.17 -45.41 91.08 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.898 0.38 . . . . 10.0 111.434 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.78 -36.74 93.77 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.932 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.413 ' HA ' ' OE2' ' A' ' 74' ' ' GLU . 6.8 t-20 -74.37 -28.48 61.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.807 0.337 . . . . 10.0 110.919 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 71.6 mmtt -66.86 -28.43 68.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.898 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.553 HD11 ' HB3' ' B' ' 66' ' ' LEU . 31.4 mt -85.4 -2.38 58.04 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.773 0.286 . . . . 10.0 111.773 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.413 ' OE2' ' HA ' ' A' ' 71' ' ' ASN . 46.9 mt-10 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.507 -0.759 . . . . 10.0 110.831 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 120.881 0.372 . . . . 10.0 110.116 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.28 163.17 13.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -75.54 -47.91 24.77 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -136.9 94.0 2.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.832 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.797 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 25.9 tp -67.64 143.05 56.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.592 179.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.517 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.7 tppt? -78.16 131.7 37.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.649 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.651 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.3 p90 -159.49 174.43 14.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.843 179.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -156.56 133.19 10.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.411 ' HA ' HG12 ' B' ' 30' ' ' VAL . 54.3 mt -83.59 104.17 11.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.16 0.505 . . . . 10.0 110.582 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.5 mm -71.8 -50.29 39.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.504 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -159.99 128.19 4.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.232 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -75.54 145.46 41.25 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 93.6 mt -116.61 -70.94 0.76 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.248 -0.581 . . . . 10.0 111.892 -179.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.493 HD12 ' CB ' ' A' ' 68' ' ' GLU . 14.2 mm -133.46 140.4 46.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.09 0.472 . . . . 10.0 111.654 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.88 119.82 57.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 107.589 -1.263 . . . . 10.0 107.589 177.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . 0.452 HD13 ' HB3' ' A' ' 61' ' ' GLU . 35.5 mt -86.51 -81.42 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.453 -0.499 . . . . 10.0 111.971 -177.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.54 -168.5 0.15 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.459 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 30.1 mp0 -108.97 142.06 40.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 178.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -82.57 -169.72 2.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.908 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.84 65.75 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.326 0.584 . . . . 10.0 111.012 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . 0.451 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 24.8 mttt -94.35 4.24 54.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.088 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 82.85 5.86 88.97 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.752 -0.737 . . . . 10.0 111.823 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.459 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -59.36 106.1 0.41 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.726 0.298 . . . . 10.0 111.452 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' B' ' 43' ' ' THR . 10.5 tpp85 -83.58 99.76 10.38 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.491 ' HG2' HG22 ' B' ' 43' ' ' THR . 92.5 mttt -84.95 117.71 24.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 110.818 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -134.76 154.05 51.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.949 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.658 HD13 ' HB ' ' B' ' 41' ' ' ILE . 46.7 tp -123.96 107.41 11.31 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.138 -1.06 . . . . 10.0 108.138 178.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -135.52 152.54 51.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.175 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -88.83 114.47 25.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' B' ' 9' ' ' ILE . 11.3 m -123.07 161.63 24.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.661 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.51 123.94 41.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.89 0.376 . . . . 10.0 110.246 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -64.07 109.4 1.81 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.839 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 63.7 m-80 59.46 30.23 19.88 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.109 -178.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 26.6 t70 63.53 29.55 15.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.994 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -122.58 -71.76 0.71 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.491 -0.322 . . . . 10.0 111.786 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -89.18 112.58 52.0 Favored Pre-proline 0 C--N 1.329 -0.316 0 N-CA-C 111.887 0.328 . . . . 10.0 111.887 -178.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -79.8 119.65 4.07 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.017 1.811 . . . . 10.0 110.562 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -151.42 173.5 14.48 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.719 -0.392 . . . . 10.0 110.171 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -93.28 135.52 34.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.57 0.224 . . . . 10.0 111.159 -179.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -147.44 129.81 15.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.658 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.8 tt -105.7 123.29 60.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.247 0.546 . . . . 10.0 110.115 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.515 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.5 mtt85 -146.11 178.75 7.98 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.418 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.499 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -126.16 145.15 50.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.984 179.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -117.76 174.13 6.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.186 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 156.26 82.38 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 178.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.77 -36.42 98.55 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.433 2.088 . . . . 10.0 112.662 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.34 1.81 56.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.028 0.442 . . . . 10.0 110.697 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.59 44.99 20.03 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.11 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -93.5 -37.55 11.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.622 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -140.25 173.4 11.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.333 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.512 ' O ' " H1'" ' C' ' 13' ' ' ' DT' . 0.0 OUTLIER -135.86 170.74 15.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.985 -1.007 . . . . 10.0 110.819 -178.057 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.604 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -133.54 -165.95 11.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.127 -0.559 . . . . 10.0 111.762 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.6 151.94 18.91 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.139 -0.624 . . . . 10.0 111.872 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.413 ' HA3' ' HG2' ' B' ' 42' ' ' ARG . . . -146.58 -133.13 2.43 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.176 -0.92 . . . . 10.0 110.83 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tt -142.22 145.36 23.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 117.498 0.649 . . . . 10.0 111.478 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -103.55 144.92 30.78 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.353 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.51 130.28 51.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.244 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -77.95 163.43 25.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -56.62 -52.73 63.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.542 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.8 pt-20 -58.98 -44.37 91.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 10.0 111.157 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -63.95 -45.37 89.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.706 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.457 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 3.9 t80 -63.21 -39.69 95.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.328 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.87 -52.39 53.22 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.304 179.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 60' ' ' GLU . 21.5 t -60.87 -43.97 96.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.088 0.471 . . . . 10.0 109.933 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.93 -55.53 33.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.917 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.553 ' HB3' HD11 ' A' ' 73' ' ' LEU . 52.5 mt -57.98 -50.74 72.34 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.354 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -49.38 -55.13 13.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.022 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.681 ' HB3' HD12 ' A' ' 14' ' ' ILE . 36.6 mm-40 -69.05 -45.85 69.33 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.88 -178.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.66 ' HB3' HD22 ' A' ' 66' ' ' LEU . 71.7 mt -60.88 -44.23 97.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.813 0.339 . . . . 10.0 111.648 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.32 -37.53 94.74 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.735 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . 0.485 ' HA ' ' OE2' ' B' ' 74' ' ' GLU . 9.3 t-20 -73.3 -31.47 64.05 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.843 0.354 . . . . 10.0 110.765 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.3 mmtt -64.09 -25.88 68.3 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.55 0.574 . . . . 10.0 112.55 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.653 HD11 ' HB3' ' A' ' 66' ' ' LEU . 26.0 mt -90.42 4.94 49.53 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.829 -0.348 . . . . 10.0 111.689 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.485 ' OE2' ' HA ' ' B' ' 71' ' ' ASN . 45.7 mt-10 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.325 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . 0.458 H2'' ' HD3' ' A' ' 21' ' ' LYS . . . . . . . . 0 C2'--C1' 1.512 -0.635 0 C3'-C2'-C1' 101.599 -0.786 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.515 H2'' " O5'" ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.892 0 C3'-C2'-C1' 101.487 -0.866 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . 0.515 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.967 0 O4'-C1'-C2' 104.089 -1.828 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.802 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 O4'-C4'-C3' 103.508 -2.092 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.626 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C4'-C3' 103.517 -2.083 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.872 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.433 0.963 0 C5'-C4'-O4' 113.123 2.327 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 C3'-C2'-C1' 101.052 -1.177 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . 0.451 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 C3'-C2'-C1' 101.471 -0.878 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . 0.483 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.926 0 C3'-C2'-C1' 101.767 -0.666 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.512 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 O4'-C1'-C2' 104.432 -1.517 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.797 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 O4'-C4'-C3' 103.498 -2.102 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.708 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.423 -1.055 0 O4'-C4'-C3' 103.71 -1.89 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.882 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.433 0.963 0 C5'-C4'-O4' 113.203 2.377 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.831 0 C3'-C2'-C1' 101.061 -1.17 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 CA-C-O 120.845 0.355 . . . . 10.0 110.558 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.64 168.53 9.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.194 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -64.74 -58.35 6.49 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.357 -0.609 . . . . 10.0 109.357 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -136.75 110.69 8.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.066 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.857 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 26.0 tp -80.38 133.12 35.87 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 178.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.431 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 18.0 tppt? -67.65 133.79 49.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.829 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.505 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 15.8 p90 -158.1 168.03 28.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.277 -0.42 . . . . 10.0 109.919 179.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 12.3 tp10 -149.19 125.54 10.86 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.886 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 30' ' ' VAL . 61.4 mt -79.31 106.08 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.55 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.6 mm -72.06 -46.08 60.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.01 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.81 132.57 1.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.651 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -75.93 145.12 40.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.969 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 79.5 mt -112.65 -74.79 0.62 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.662 -0.415 . . . . 10.0 111.635 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.682 HD12 ' HB3' ' B' ' 68' ' ' GLU . 30.6 mm -132.37 137.37 54.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.767 0.655 . . . . 10.0 112.767 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.417 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.0 p -118.85 125.36 74.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.035 -1.098 . . . . 10.0 108.035 177.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.504 HD22 ' HB ' ' B' ' 64' ' ' VAL . 30.1 mt -94.18 -81.32 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 10.0 112.073 -177.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.0 m -172.88 -168.36 0.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.77 -0.456 . . . . 10.0 109.77 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.515 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 2.2 mp0 -112.37 135.06 53.52 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -73.27 -173.67 1.4 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.75 0.31 . . . . 10.0 110.728 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.82 -20.79 66.59 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.611 0.72 . . . . 10.0 109.896 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -91.1 -1.81 57.7 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.767 -1.106 . . . . 10.0 110.522 -179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.48 1.19 85.99 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.987 -0.845 . . . . 10.0 110.987 -178.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.515 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.2 m0 -60.27 108.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.82 0.343 . . . . 10.0 111.606 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' A' ' 43' ' ' THR . 6.8 tpp85 -86.93 99.61 11.99 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.407 178.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.625 ' HG2' HG22 ' A' ' 43' ' ' THR . 86.2 mttt -83.05 118.54 23.6 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.07 0.462 . . . . 10.0 110.587 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.417 ' HG2' HG23 ' A' ' 15' ' ' VAL . 60.1 mt-10 -133.52 145.17 49.9 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.853 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.716 HD13 ' HB ' ' A' ' 41' ' ' ILE . 40.7 tp -115.38 107.86 15.77 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.226 -1.027 . . . . 10.0 108.226 178.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -133.77 159.1 41.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.933 0.397 . . . . 10.0 110.958 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -94.08 114.09 26.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 9' ' ' ILE . 17.1 m -127.31 158.77 38.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.896 0.379 . . . . 10.0 110.821 -179.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.495 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 1.5 p -98.41 125.53 43.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.958 0.409 . . . . 10.0 110.475 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -64.23 108.95 1.71 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.843 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.0 m-80 61.19 25.66 15.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.027 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.9 t70 66.89 21.81 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.794 -1.093 . . . . 10.0 110.437 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.12 -75.92 0.61 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.281 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -98.89 120.74 57.94 Favored Pre-proline 0 C--N 1.329 -0.292 0 N-CA-C 111.776 0.287 . . . . 10.0 111.776 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 60.3 Cg_endo -79.45 120.81 4.53 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.861 2.374 . . . . 10.0 111.477 178.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.9 ttmm -143.52 168.49 19.74 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -92.02 129.5 37.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.596 0.236 . . . . 10.0 110.694 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.451 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -141.83 132.46 25.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.716 ' HB ' HD13 ' A' ' 27' ' ' LEU . 8.8 tt -110.78 121.21 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.239 0.542 . . . . 10.0 110.048 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.525 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.8 mtt85 -143.23 -178.74 6.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.446 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.625 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -125.61 143.02 51.21 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.125 179.5 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -117.91 169.31 9.74 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.664 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.18 156.46 87.99 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.62 -27.81 84.04 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.267 1.978 . . . . 10.0 112.048 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -94.75 -0.86 53.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.817 -0.628 . . . . 10.0 110.417 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 58.71 31.37 21.09 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.718 -0.673 . . . . 10.0 111.004 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -82.08 -36.41 27.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.895 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -137.8 175.22 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.359 0.599 . . . . 10.0 111.332 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.429 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -135.1 172.21 13.33 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.86 -1.064 . . . . 10.0 110.558 -178.091 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.664 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.08 -164.9 10.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.971 -0.633 . . . . 10.0 112.157 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -96.31 151.74 19.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 121.937 -0.743 . . . . 10.0 112.073 -179.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.26 -126.98 1.53 Allowed Glycine 0 C--N 1.332 0.349 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.21 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 tt -142.98 145.06 23.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-N 117.599 0.7 . . . . 10.0 111.453 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.481 ' HB ' ' H71' ' C' ' 7' ' ' ' DT' . 1.0 OUTLIER -107.7 139.96 41.48 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.886 179.782 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 36.7 mt -124.19 132.31 53.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.889 0.376 . . . . 10.0 110.275 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 m -76.56 164.55 25.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.934 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -60.82 -44.04 97.43 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.701 0.259 . . . . 10.0 111.701 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -60.43 -47.29 86.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.197 0.522 . . . . 10.0 110.708 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.573 ' HB3' HD13 ' B' ' 16' ' ' LEU . 38.6 mt-10 -64.03 -45.2 89.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.597 179.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.721 ' CE2' HD11 ' A' ' 66' ' ' LEU . 20.3 t80 -58.25 -44.45 88.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.329 -0.85 . . . . 10.0 111.005 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.54 -52.72 51.45 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.312 -0.47 . . . . 10.0 112.379 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.5 t -61.9 -42.85 96.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 120.969 0.414 . . . . 10.0 110.587 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.548 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 22.8 tp -57.42 -55.65 32.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.584 -0.735 . . . . 10.0 110.932 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.721 HD11 ' CE2' ' A' ' 62' ' ' PHE . 20.3 mt -63.25 -43.03 99.17 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.007 -0.277 . . . . 10.0 111.614 -179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.3 ttpp -51.56 -51.54 54.52 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.424 0.453 . . . . 10.0 111.189 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.549 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 32.8 mm-40 -71.89 -44.18 64.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.394 -179.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 73.2 mt -58.8 -45.31 90.19 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.61 0.226 . . . . 10.0 111.61 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.26 94.54 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.6 -0.809 . . . . 10.0 111.092 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.25 -29.69 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 10.0 110.591 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 34.3 mmtt -68.67 -25.25 64.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.22 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.572 HD11 ' HB3' ' B' ' 66' ' ' LEU . 37.4 mt -89.55 -0.79 57.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.666 -179.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.138 -0.934 . . . . 10.0 111.019 -179.216 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.03 0.443 . . . . 10.0 110.553 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.98 164.78 11.69 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -62.57 -58.26 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.464 0.649 . . . . 10.0 109.449 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -134.15 112.92 11.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.056 -0.975 . . . . 10.0 109.36 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.796 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 32.2 tp -82.33 133.95 35.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.6 tppt? -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.948 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.571 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 12.5 p90 -155.48 163.84 39.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.254 -0.43 . . . . 10.0 109.842 179.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.488 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.5 tp10 -145.97 126.49 14.14 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.597 -0.52 . . . . 10.0 109.597 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.484 ' HA ' HG12 ' B' ' 30' ' ' VAL . 39.5 mt -79.6 108.78 13.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.453 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 30.8 mm -74.86 -45.1 44.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.874 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -170.15 134.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.655 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -76.89 144.56 38.85 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.616 179.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 76.2 mt -113.76 -72.21 0.71 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.449 -0.5 . . . . 10.0 112.08 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.447 HD12 ' CB ' ' A' ' 68' ' ' GLU . 13.2 mm -131.52 139.15 51.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.038 0.447 . . . . 10.0 111.996 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 p -122.83 123.89 69.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.665 -1.235 . . . . 10.0 107.665 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . 0.573 HD13 ' HB3' ' A' ' 61' ' ' GLU . 41.4 mt -93.38 -82.06 0.35 Allowed 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.045 -0.662 . . . . 10.0 112.023 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 4.6 m -174.19 -167.9 0.36 Allowed 'General case' 0 C--O 1.236 0.388 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.517 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 2.0 mp0 -111.87 134.99 53.07 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 10.0 109.916 178.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -72.73 -175.87 1.82 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.51 66.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.518 0.675 . . . . 10.0 110.211 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -89.7 -3.49 58.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.265 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.94 3.37 79.95 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.234 -0.746 . . . . 10.0 111.234 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.517 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -61.59 108.58 1.0 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.686 0.279 . . . . 10.0 111.483 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' B' ' 43' ' ' THR . 5.5 tpp85 -86.49 99.97 12.04 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.351 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' B' ' 43' ' ' THR . 86.8 mttt -83.18 118.6 23.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.933 0.397 . . . . 10.0 110.761 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -133.91 144.48 48.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.748 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.692 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.9 tp -114.87 107.82 15.93 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -133.76 160.22 38.25 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.984 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' B' ' 29' ' ' ARG . 20.8 ttm180 -95.52 114.23 25.97 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.484 HG12 ' HA ' ' B' ' 9' ' ' ILE . 17.8 m -127.1 158.03 38.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.985 0.421 . . . . 10.0 110.587 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.2 p -97.35 126.05 42.34 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.032 0.444 . . . . 10.0 110.494 179.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -64.21 108.71 1.64 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.492 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 67.5 m-80 60.34 26.43 15.95 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.836 0.71 . . . . 10.0 110.267 -178.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 67.25 22.29 9.69 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.046 -0.979 . . . . 10.0 110.922 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.41 -75.35 0.63 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.062 -0.399 . . . . 10.0 111.429 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.675 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 33.5 tt0 -98.86 118.78 62.38 Favored Pre-proline 0 C--N 1.33 -0.264 0 N-CA-C 111.71 0.263 . . . . 10.0 111.71 -178.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 61.7 Cg_endo -77.89 120.77 5.18 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.781 2.32 . . . . 10.0 111.514 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.43 ' HG2' ' H ' ' B' ' 39' ' ' TYR . 21.1 ttmm -143.1 169.98 16.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . 0.43 ' H ' ' HG2' ' B' ' 38' ' ' LYS . 22.4 m-85 -93.55 128.95 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.716 0.293 . . . . 10.0 110.556 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -141.43 132.39 26.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.692 ' HB ' HD13 ' B' ' 27' ' ' LEU . 8.5 tt -110.71 122.07 64.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.257 0.551 . . . . 10.0 110.013 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.488 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 2.7 mtt85 -144.18 -179.74 6.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.209 -177.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.581 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -125.17 143.41 50.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.138 179.853 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -117.82 171.37 8.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.022 -0.536 . . . . 10.0 109.664 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -68.44 157.04 89.12 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -22.15 70.45 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.414 2.076 . . . . 10.0 111.859 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -100.72 0.07 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.13 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 58.34 30.05 19.02 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.075 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.1 -39.96 28.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.094 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -135.44 174.5 10.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 10.0 111.516 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.412 ' HG3' ' C2 ' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -134.57 172.47 12.88 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.949 -1.023 . . . . 10.0 110.533 -178.29 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.686 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.34 -161.95 9.01 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.127 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -99.44 147.08 25.65 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.989 -0.713 . . . . 10.0 112.142 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.431 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -141.98 -124.44 1.96 Allowed Glycine 0 C--N 1.331 0.287 0 CA-C-N 115.144 -0.934 . . . . 10.0 110.777 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.9 tt -145.82 146.46 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 117.556 0.678 . . . . 10.0 110.807 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.9 m -107.79 139.89 41.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.197 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.3 mt -124.25 132.29 53.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.234 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -77.23 166.78 22.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.179 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.26 -40.78 96.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.677 -0.238 . . . . 10.0 111.288 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.516 ' O ' HG23 ' B' ' 64' ' ' VAL . 9.4 pt-20 -63.76 -44.74 92.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.421 . . . . 10.0 110.511 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.445 ' OE2' ' HD2' ' A' ' 25' ' ' LYS . 36.1 mt-10 -66.47 -46.85 74.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.608 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.451 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.5 t80 -58.23 -39.26 78.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.438 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.61 -49.72 75.47 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.203 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 60' ' ' GLU . 8.2 t -66.5 -43.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.044 0.449 . . . . 10.0 110.432 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.3 tp -56.27 -54.73 41.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.887 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.572 ' HB3' HD11 ' A' ' 73' ' ' LEU . 48.9 mt -61.19 -47.82 84.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.126 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -50.49 -53.59 28.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.689 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.682 ' HB3' HD12 ' A' ' 14' ' ' ILE . 27.8 mm-40 -69.5 -47.17 64.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.844 -178.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.501 ' HB3' HD22 ' A' ' 66' ' ' LEU . 70.6 mt -60.13 -41.2 92.18 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.752 0.279 . . . . 10.0 111.752 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.21 -36.27 92.65 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.603 -0.808 . . . . 10.0 111.267 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -74.05 -29.66 62.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.077 0.465 . . . . 10.0 110.775 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 38.6 mmtt -65.56 -26.45 67.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.611 HD11 ' CB ' ' A' ' 66' ' ' LEU . 27.0 mt -89.44 3.24 52.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.694 0.283 . . . . 10.0 111.558 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 C--O 1.254 1.29 0 CA-C-O 118.567 -0.73 . . . . 10.0 110.105 179.694 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O5'-C5'-C4' 109.13 -0.764 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.717 0 C3'-C2'-C1' 101.363 -0.955 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.954 0 C1'-O4'-C4' 107.315 -1.704 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.857 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.519 -0.897 0 O4'-C4'-C3' 103.506 -2.094 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.48 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 O4'-C4'-C3' 103.373 -2.227 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.813 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.9 0 C5'-C4'-O4' 113.044 2.278 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . 0.481 ' H71' ' HB ' ' A' ' 56' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C3'-C2'-C1' 101.482 -0.87 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 C3'-C2'-C1' 101.612 -0.777 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 C3'-C2'-C1' 101.723 -0.698 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.422 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.843 0 O4'-C1'-C2' 104.528 -1.429 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.796 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O4'-C4'-C3' 103.433 -2.167 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.488 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.829 0 O4'-C4'-C3' 103.502 -2.098 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.802 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.429 0.67 0 C5'-C4'-O4' 113.034 2.271 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.675 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 C3'-C2'-C1' 100.525 -1.554 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.8 mtm . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 120.879 0.371 . . . . 10.0 110.539 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.12 160.29 14.39 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.416 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 13.0 t70 -62.19 -57.32 11.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 39.1 mmtm -138.29 94.29 2.85 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.851 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 26.5 tp -64.7 137.8 58.02 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 16.6 tppt? -71.75 134.29 46.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.148 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.446 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 13.0 p90 -159.58 170.12 22.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.006 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.444 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.13 133.52 11.81 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.285 -0.416 . . . . 10.0 109.938 178.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 70.7 mt -80.74 110.48 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.107 0.479 . . . . 10.0 110.418 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.426 HG13 ' HB3' ' A' ' 37' ' ' PRO . 33.4 mm -82.8 -39.61 15.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.215 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -167.3 139.35 3.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.841 -179.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.15 137.08 32.93 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 53.1 mt -104.55 -76.01 0.61 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.488 -0.485 . . . . 10.0 110.828 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.796 HD12 ' HB3' ' B' ' 68' ' ' GLU . 26.6 mm -134.92 134.22 53.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.222 0.534 . . . . 10.0 111.848 -178.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.418 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.7 p -114.63 121.93 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 177.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' B' ' 61' ' ' GLU . 32.0 mt -89.38 -80.67 0.3 Allowed 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.496 -0.482 . . . . 10.0 111.837 -177.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.2 m -179.64 -168.57 0.12 Allowed 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.293 0.371 . . . . 10.0 110.058 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 6.1 mp0 -110.49 146.33 36.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.402 ' CG ' ' H ' ' A' ' 20' ' ' ALA . 11.9 t-20 -89.55 -168.82 2.27 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.132 -0.692 . . . . 10.0 109.132 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.402 ' H ' ' CG ' ' A' ' 19' ' ' ASN . . . -64.28 -26.42 68.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.481 0.658 . . . . 10.0 111.006 -178.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -85.94 -0.14 54.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.218 -0.901 . . . . 10.0 110.837 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.25 2.98 90.37 Favored Glycine 0 N--CA 1.444 -0.773 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -58.56 108.89 0.69 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 111.467 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.5 tpp85 -79.96 108.93 13.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.17 178.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.564 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 61.5 mttt -88.89 109.82 20.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.194 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.418 ' HG2' HG23 ' A' ' 15' ' ' VAL . 48.2 mt-10 -133.28 149.3 51.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.627 0.727 . . . . 10.0 112.412 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.853 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.4 tp -122.36 108.54 13.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.518 -1.219 . . . . 10.0 107.882 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -134.16 166.28 23.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.304 0.574 . . . . 10.0 111.961 -177.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 29' ' ' ARG . 6.3 ttm180 -98.71 114.33 26.8 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.6 m -128.71 156.83 41.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.761 0.315 . . . . 10.0 110.651 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.444 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.8 OUTLIER -93.51 123.91 37.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.252 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -64.4 108.82 1.73 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.784 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.404 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.4 m-80 60.74 30.3 19.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.932 -178.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t0 66.29 18.77 10.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.669 -1.151 . . . . 10.0 111.206 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -100.26 -93.1 0.28 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.599 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -84.94 126.59 67.61 Favored Pre-proline 0 C--O 1.233 0.22 0 CA-C-O 120.582 0.23 . . . . 10.0 111.593 -179.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.426 ' HB3' HG13 ' A' ' 10' ' ' ILE . 71.6 Cg_endo -81.0 120.42 3.76 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.042 2.495 . . . . 10.0 111.818 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -139.36 167.04 22.97 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -92.52 129.93 38.32 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.506 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t0 -139.88 132.94 29.53 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.892 -0.411 . . . . 10.0 109.892 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.853 ' HB ' HD13 ' A' ' 27' ' ' LEU . 13.7 tt -109.33 122.01 63.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.55 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtt85 -144.91 170.87 15.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.508 0.67 . . . . 10.0 112.103 -177.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.564 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.32 131.49 55.93 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 114.881 -1.054 . . . . 10.0 110.205 179.458 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -117.43 176.7 5.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.255 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.88 156.71 84.31 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -55.3 -37.5 94.47 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.729 2.286 . . . . 10.0 112.557 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -94.22 3.57 55.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.239 0.542 . . . . 10.0 110.555 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.8 m170 61.09 26.32 16.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.618 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.18 -35.06 77.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.728 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 50' ' ' LYS . 36.4 mmtm -141.76 174.42 10.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.533 . . . . 10.0 111.291 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.88 172.29 11.84 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.07 -0.968 . . . . 10.0 110.457 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.522 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -139.93 -175.28 14.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.813 -0.708 . . . . 10.0 112.461 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -91.85 139.03 31.06 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.427 -0.455 . . . . 10.0 111.901 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.4 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -138.77 -121.2 1.9 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.369 -0.832 . . . . 10.0 111.174 179.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.3 tt -150.67 143.73 17.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.335 0.568 . . . . 10.0 111.012 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 m -104.39 135.59 45.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.53 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.8 mt -113.9 121.99 45.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.58 176.92 9.26 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.8 -0.36 . . . . 10.0 110.448 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.78 -41.5 91.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.192 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.495 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 13.4 pt-20 -56.14 -47.88 77.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.336 0.589 . . . . 10.0 110.739 178.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.495 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 30.1 mt-10 -67.16 -60.18 2.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.329 -0.851 . . . . 10.0 111.663 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.621 ' CE2' HD11 ' A' ' 66' ' ' LEU . 5.1 t80 -48.29 -45.11 34.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.235 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.8 -54.69 34.85 Favored Glycine 0 C--O 1.237 0.313 0 C-N-CA 121.389 -0.434 . . . . 10.0 113.264 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.9 t -69.58 -43.62 80.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.736 0.303 . . . . 10.0 111.419 -179.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.96 -52.45 65.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.431 -178.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.628 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.3 mt -62.93 -46.15 89.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 120.788 -0.365 . . . . 10.0 111.465 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -52.32 -50.42 62.29 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.598 0.562 . . . . 10.0 110.906 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.658 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 34.6 mm-40 -70.55 -50.15 40.55 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.813 -0.631 . . . . 10.0 111.947 -179.045 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 mt -55.89 -47.49 77.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.574 0.226 . . . . 10.0 111.58 -179.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.93 -31.22 80.21 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.601 -0.809 . . . . 10.0 111.592 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -74.37 -32.85 62.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.64 0.257 . . . . 10.0 111.116 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.658 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 33.3 mmtt -70.22 -24.24 63.06 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.71 0.29 . . . . 10.0 110.971 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' B' ' 66' ' ' LEU . 22.5 mt -85.05 -6.46 59.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.113 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.442 -0.79 . . . . 10.0 110.634 -179.542 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.871 0.367 . . . . 10.0 110.23 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.82 163.82 14.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -68.93 -55.12 11.98 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -137.94 93.24 2.75 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.934 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.83 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 34.6 tp -63.91 139.82 58.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.376 . . . . 10.0 110.656 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -74.33 134.88 42.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.852 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.594 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 11.9 p90 -161.31 171.31 18.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.491 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -156.48 131.59 9.18 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -78.53 108.61 12.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.239 0.543 . . . . 10.0 110.534 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' B' ' 37' ' ' PRO . 24.5 mm -80.8 -40.52 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.936 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -166.79 138.91 3.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.621 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -84.22 139.63 32.23 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.4 mt -108.05 -73.42 0.69 Allowed 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.433 -0.507 . . . . 10.0 111.274 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.589 HD12 ' HB3' ' A' ' 68' ' ' GLU . 14.7 mm -136.13 132.62 50.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.815 0.34 . . . . 10.0 111.761 -178.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.441 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -114.05 122.29 67.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 107.578 -1.268 . . . . 10.0 107.578 176.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 35.7 mt -88.31 -81.13 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.429 -0.509 . . . . 10.0 111.83 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 179.06 -169.21 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.543 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 11.5 mp0 -109.56 145.68 35.94 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.072 -0.344 . . . . 10.0 110.072 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -88.09 -168.28 2.16 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.62 -22.27 66.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.192 0.52 . . . . 10.0 111.155 -179.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -91.02 1.8 56.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 0.95 90.08 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.111 -0.796 . . . . 10.0 111.111 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.5 m0 -56.53 109.39 0.61 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.576 -0.312 . . . . 10.0 111.697 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.3 tpp85 -80.03 110.63 15.6 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.525 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 61.0 mttt -90.04 110.86 21.83 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.394 -179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.441 ' HG2' HG23 ' B' ' 15' ' ' VAL . 48.1 mt-10 -134.74 150.37 50.56 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.627 0.727 . . . . 10.0 112.333 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.81 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.3 tp -123.97 108.9 12.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.556 -1.202 . . . . 10.0 108.006 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -134.25 166.59 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.18 0.514 . . . . 10.0 111.828 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' B' ' 29' ' ' ARG . 7.2 ttm180 -98.05 113.75 25.72 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.32 -0.992 . . . . 10.0 108.32 178.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 13.5 m -128.74 155.46 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.887 0.375 . . . . 10.0 110.735 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.4 p -93.05 124.89 37.34 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.922 0.391 . . . . 10.0 110.584 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -64.44 109.32 1.9 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.689 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 60.3 29.9 19.39 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.539 0.685 . . . . 10.0 109.779 -178.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 41.7 t0 65.37 22.18 11.98 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.269 -1.332 . . . . 10.0 111.154 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.41 -89.18 0.38 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.488 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.6 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 34.5 tt0 -88.79 125.9 61.32 Favored Pre-proline 0 C--O 1.235 0.302 0 CA-C-O 120.705 0.288 . . . . 10.0 111.426 -178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.423 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 73.4 Cg_endo -79.07 121.81 5.05 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.804 2.336 . . . . 10.0 111.582 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -140.49 164.31 30.47 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -90.75 127.68 36.41 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.514 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t0 -138.27 134.0 33.81 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.81 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.9 tt -110.21 120.95 62.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.514 ' HG3' ' OD1' ' B' ' 40' ' ' ASP . 3.0 mtt85 -143.9 169.84 17.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.543 0.687 . . . . 10.0 112.286 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.525 ' CG2' ' HG2' ' B' ' 25' ' ' LYS . 0.0 OUTLIER -113.21 131.13 56.01 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 114.838 -1.074 . . . . 10.0 110.356 179.467 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m0 -117.5 175.41 5.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.234 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.84 158.04 86.52 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -58.12 -33.02 96.94 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.529 2.152 . . . . 10.0 112.32 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -94.87 1.04 55.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.473 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 24.8 m170 62.28 24.27 14.43 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.284 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -66.99 -38.28 85.75 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.856 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -139.48 174.27 10.69 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.209 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.22 172.76 11.46 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.648 -178.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.433 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -139.9 -173.51 13.28 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.518 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 6.8 mtpp -93.64 136.31 34.05 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 122.243 -0.563 . . . . 10.0 111.863 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.45 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -134.96 -123.01 2.29 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 110.65 -0.98 . . . . 10.0 110.65 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.3 tt -150.43 143.05 17.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.39 0.595 . . . . 10.0 110.798 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -102.96 134.58 46.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.731 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 46.7 mt -112.69 120.24 40.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.96 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.06 174.97 11.06 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.935 -0.306 . . . . 10.0 110.414 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -58.37 -42.6 87.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.54 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.477 ' O ' HG23 ' B' ' 64' ' ' VAL . 12.1 pt-20 -55.91 -43.83 77.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.387 0.613 . . . . 10.0 110.678 178.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.543 ' HA ' HD13 ' A' ' 16' ' ' LEU . 31.3 mt-10 -70.94 -58.58 3.44 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.365 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 0.8 OUTLIER -52.74 -40.62 63.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.594 -178.425 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.27 -56.33 24.25 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.905 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.518 ' HB ' HD22 ' A' ' 16' ' ' LEU . 13.5 t -68.24 -44.79 83.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.844 0.354 . . . . 10.0 111.366 -179.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 21.1 tp -57.12 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.531 -178.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.651 ' HB3' HD11 ' A' ' 73' ' ' LEU . 23.4 mt -60.1 -52.74 64.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.6 0.238 . . . . 10.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttm -49.05 -51.71 29.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.642 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.796 ' HB3' HD12 ' A' ' 14' ' ' ILE . 55.2 mm-40 -69.56 -51.31 36.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.124 -0.489 . . . . 10.0 112.092 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.628 ' HB3' HD22 ' A' ' 66' ' ' LEU . 62.4 mt -57.05 -46.16 82.66 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.701 0.26 . . . . 10.0 111.701 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.35 93.28 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.282 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . 0.423 ' HA ' ' HG3' ' B' ' 74' ' ' GLU . 2.0 t-20 -72.06 -30.83 65.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.58 -0.31 . . . . 10.0 111.688 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.677 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 13.9 mmtt -69.36 -25.48 64.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.541 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.579 HD11 ' HB3' ' A' ' 66' ' ' LEU . 19.1 mt -88.62 -2.76 58.76 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.384 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.423 ' HG3' ' HA ' ' B' ' 71' ' ' ASN . 36.6 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.955 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C3'-C2'-C1' 101.902 -0.57 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.418 ' H71' ' O ' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 C3'-C2'-C1' 101.348 -0.965 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -0.968 0 O4'-C1'-C2' 104.184 -1.742 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.851 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 O4'-C4'-C3' 103.408 -2.192 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.482 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 O4'-C4'-C3' 103.546 -2.054 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.906 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.904 0 C5'-C4'-O4' 113.184 2.365 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 C3'-C2'-C1' 101.166 -1.096 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.843 0 C3'-C2'-C1' 101.167 -1.095 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . 0.498 ' H73' ' HB ' ' B' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C3'-C2'-C1' 101.93 -0.55 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.929 0 O4'-C1'-C2' 104.348 -1.592 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.83 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.835 0 O4'-C4'-C3' 103.528 -2.072 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.481 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 O4'-C4'-C3' 103.857 -1.743 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.88 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.822 0 C5'-C4'-O4' 113.092 2.308 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.6 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.425 -0.931 0 C3'-C2'-C1' 100.82 -1.343 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.789 0.328 . . . . 10.0 110.426 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.47 163.53 13.37 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -72.28 -50.86 23.9 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.611 -0.514 . . . . 10.0 109.611 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -134.77 94.57 3.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.887 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.691 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.3 tp -68.46 140.53 55.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.463 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.48 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -74.53 131.47 41.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.616 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.553 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 11.4 p90 -158.03 171.83 19.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.393 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.418 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.2 tp10 -155.27 135.19 12.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.346 -0.612 . . . . 10.0 109.346 178.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.425 ' HA ' HG12 ' A' ' 30' ' ' VAL . 65.1 mt -83.38 117.47 29.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 mm -84.95 -49.25 15.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.293 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -165.77 134.17 3.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.263 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -79.47 137.83 37.36 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.276 -0.638 . . . . 10.0 109.276 178.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.572 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 87.9 mt -105.75 -72.1 0.72 Allowed 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.793 -0.363 . . . . 10.0 111.467 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.606 HD12 ' HB3' ' B' ' 68' ' ' GLU . 27.2 mm -131.75 140.86 47.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.094 0.474 . . . . 10.0 111.924 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.76 120.8 58.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 108.11 -1.07 . . . . 10.0 108.11 177.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.608 HD22 ' HB ' ' B' ' 64' ' ' VAL . 25.6 mt -91.02 -80.77 0.33 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.629 -0.429 . . . . 10.0 111.159 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 179.36 -170.38 0.13 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -106.67 140.08 40.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.817 0.341 . . . . 10.0 110.239 179.004 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -77.48 -174.63 3.43 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.01 -24.47 67.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.536 0.684 . . . . 10.0 110.837 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.415 ' HB3' H2'' ' C' ' 1' ' ' ' DT' . 20.7 mttt -90.21 3.02 54.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.155 -0.93 . . . . 10.0 110.692 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.06 6.01 87.01 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.207 -0.757 . . . . 10.0 111.207 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.433 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.6 m0 -62.1 100.33 0.16 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.839 0.352 . . . . 10.0 111.346 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 43' ' ' THR . 13.3 tpp85 -81.12 99.42 8.5 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.964 -0.754 . . . . 10.0 108.964 178.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' A' ' 43' ' ' THR . 89.9 mttt -83.5 112.23 19.78 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.864 0.364 . . . . 10.0 110.52 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -131.55 149.31 52.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.842 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.679 HD13 ' HB ' ' A' ' 41' ' ' ILE . 38.3 tp -118.3 108.16 14.76 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.099 -1.075 . . . . 10.0 108.099 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -133.38 160.7 36.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 10.0 111.152 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 29' ' ' ARG . 32.6 ttm180 -96.79 114.97 26.65 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' A' ' 9' ' ' ILE . 17.2 m -127.92 160.47 37.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.801 0.334 . . . . 10.0 110.569 -179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.6 p -96.58 122.53 39.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.926 0.393 . . . . 10.0 110.453 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -64.2 109.97 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.014 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 64.2 m-80 59.12 31.0 20.91 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.781 0.676 . . . . 10.0 110.158 -178.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.4 t70 61.61 30.06 18.47 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.763 -1.108 . . . . 10.0 110.959 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -115.75 -77.83 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.058 -0.402 . . . . 10.0 111.705 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -97.12 120.47 61.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 120.631 0.253 . . . . 10.0 111.589 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.502 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 69.0 Cg_endo -78.62 120.85 4.9 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.484 2.123 . . . . 10.0 111.325 178.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -141.25 168.5 19.62 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.424 ' HD1' HD11 ' A' ' 13' ' ' LEU . 2.8 m-85 -93.26 130.47 38.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.44 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.6 t0 -141.54 130.02 22.56 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.679 ' HB ' HD13 ' A' ' 27' ' ' LEU . 6.4 tt -106.32 121.31 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.345 0.593 . . . . 10.0 109.953 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.507 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 2.9 mtt85 -144.65 177.6 8.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.19 -177.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.581 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -120.77 142.22 49.77 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.497 179.197 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -117.01 176.63 5.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.29 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.431 ' HG ' ' H ' ' A' ' 50' ' ' LYS . 2.3 p -79.39 158.38 74.04 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -58.75 -30.86 93.75 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.53 2.153 . . . . 10.0 112.162 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -94.27 -5.35 46.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.834 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 60.83 34.59 19.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.6 -178.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -88.26 -32.51 18.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.472 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.431 ' H ' ' HG ' ' A' ' 45' ' ' SER . 39.0 mmtm -141.84 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.119 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -145.42 172.73 12.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.278 -177.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.618 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -133.63 -154.82 7.49 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.092 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.4 ' HA ' ' NH2' ' A' ' 42' ' ' ARG . 36.5 mttp -101.58 157.3 16.92 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 122.169 -0.607 . . . . 10.0 112.066 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -151.81 -122.36 0.99 Allowed Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.775 -0.93 . . . . 10.0 110.775 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.3 tt -149.38 141.42 17.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 117.759 0.78 . . . . 10.0 111.367 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.51 144.67 31.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -129.79 130.66 45.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.113 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -84.97 175.21 9.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.774 -0.194 . . . . 10.0 110.905 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -53.69 -58.68 6.32 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.49 0.552 . . . . 10.0 112.49 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -57.69 -49.01 77.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.757 0.313 . . . . 10.0 111.829 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -58.99 -49.0 79.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.204 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.666 ' CE2' HD11 ' A' ' 66' ' ' LEU . 25.2 t80 -62.62 -44.07 97.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.486 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.53 -54.56 36.21 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.101 -0.499 . . . . 10.0 112.917 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.448 ' HB ' HD22 ' B' ' 16' ' ' LEU . 53.4 t -60.2 -42.14 89.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.295 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.486 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 19.4 tp -57.59 -53.06 62.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.462 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.681 HD22 ' HB3' ' B' ' 69' ' ' LEU . 17.2 mt -62.18 -46.14 90.26 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 -179.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -51.27 -51.35 54.99 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 123.635 0.584 . . . . 10.0 111.522 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.605 ' CB ' HD12 ' B' ' 14' ' ' ILE . 49.9 mm-40 -70.24 -46.69 63.93 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.339 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 69.0 mt -58.53 -44.15 89.47 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 111.682 0.253 . . . . 10.0 111.682 -179.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.57 -38.87 97.09 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.824 -0.703 . . . . 10.0 111.596 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -71.37 -29.05 64.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.813 0.34 . . . . 10.0 110.755 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 54.5 mmtt -66.55 -25.11 66.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.362 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' B' ' 66' ' ' LEU . 24.2 mt -85.68 -11.93 52.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.448 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.706 -0.664 . . . . 10.0 110.635 179.947 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.859 0.361 . . . . 10.0 110.446 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.01 160.57 16.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.416 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 14.8 t70 -72.22 -48.37 43.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.416 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 32.8 mmtm -135.05 94.46 3.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.66 -0.7 . . . . 10.0 109.546 179.006 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.741 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 26.9 tp -68.84 140.32 55.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.407 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.3 tppt? -74.05 129.72 38.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.597 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.661 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.9 p90 -158.01 170.04 23.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.064 -0.517 . . . . 10.0 110.263 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.441 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 6.2 tp10 -152.63 133.05 13.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.506 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.578 ' HA ' HG12 ' B' ' 30' ' ' VAL . 63.7 mt -82.07 117.81 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.093 0.473 . . . . 10.0 110.124 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 39.5 mm -85.24 -50.82 14.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.377 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 -162.94 133.38 4.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.43 142.64 37.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 48.1 mt -112.43 -67.95 0.96 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.64 -0.424 . . . . 10.0 111.677 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.605 HD12 ' CB ' ' A' ' 68' ' ' GLU . 21.2 mm -133.03 141.38 44.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.826 0.346 . . . . 10.0 111.787 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -128.31 116.74 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 177.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . 0.448 HD22 ' HB ' ' A' ' 64' ' ' VAL . 34.6 mt -86.14 -81.07 0.22 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.616 -177.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m 178.99 -168.48 0.09 Allowed 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.473 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 0.8 OUTLIER -108.39 141.37 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.154 -0.313 . . . . 10.0 110.154 178.841 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -78.82 -172.76 3.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.25 66.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 10.0 110.879 -179.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . 0.434 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 22.6 mttt -93.24 2.74 56.5 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.376 -0.829 . . . . 10.0 110.198 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.43 5.5 84.86 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.664 -0.779 . . . . 10.0 111.436 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.473 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.6 m0 -61.33 101.61 0.18 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.867 0.365 . . . . 10.0 111.641 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' B' ' 43' ' ' THR . 14.1 tpp85 -81.63 99.72 9.03 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.603 ' HG2' HG22 ' B' ' 43' ' ' THR . 90.5 mttt -83.46 113.6 20.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.974 0.416 . . . . 10.0 110.907 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -132.98 148.95 52.27 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.639 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.718 HD13 ' HB ' ' B' ' 41' ' ' ILE . 38.8 tp -119.3 107.62 13.62 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.084 -1.08 . . . . 10.0 108.084 178.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -133.18 161.33 34.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.968 0.413 . . . . 10.0 111.211 -177.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -97.7 114.68 26.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.578 HG12 ' HA ' ' B' ' 9' ' ' ILE . 23.0 m -127.28 159.92 36.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.518 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.2 p -95.01 122.85 38.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 10.0 110.775 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -64.27 110.45 2.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.783 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 65.1 m-80 59.43 29.26 18.8 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.23 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 64.11 24.81 13.58 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.834 -1.075 . . . . 10.0 110.903 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.9 -82.98 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.764 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.454 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 34.4 tt0 -92.42 120.41 67.53 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 10.0 111.63 -178.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 60.2 Cg_endo -76.84 124.05 7.22 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.617 2.212 . . . . 10.0 111.124 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.405 ' HD2' ' CG2' ' B' ' 56' ' ' THR . 22.0 ttmm -144.28 165.94 26.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -92.0 129.52 37.94 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.717 -0.475 . . . . 10.0 109.717 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -140.26 130.01 24.45 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.718 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.1 tt -105.53 121.59 57.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 10.0 109.951 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.48 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 2.9 mtt85 -145.04 176.85 9.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.398 -177.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.603 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -120.56 142.2 49.57 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.645 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -116.92 177.34 4.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.028 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -80.97 159.48 68.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.49 -28.79 88.37 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.385 2.056 . . . . 10.0 112.073 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -95.35 -5.75 42.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.641 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 62.53 28.35 16.68 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.984 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.55 -36.42 29.13 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.713 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -138.51 172.56 12.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.452 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.457 ' O ' " H1'" ' C' ' 13' ' ' ' DT' . 0.0 OUTLIER -146.78 172.46 13.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.418 -177.761 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.533 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -132.82 -154.67 7.61 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.676 -0.773 . . . . 10.0 112.161 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.51 156.09 17.48 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 122.2 -0.588 . . . . 10.0 111.953 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.1 -121.17 1.11 Allowed Glycine 0 N--CA 1.452 -0.297 0 N-CA-C 110.761 -0.936 . . . . 10.0 110.761 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.2 tt -151.43 141.38 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 117.74 0.77 . . . . 10.0 111.166 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.405 ' CG2' ' HD2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -103.96 145.67 29.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.591 -179.575 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 32.6 mt -128.95 128.83 44.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.272 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.9 m -83.57 173.36 11.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.696 -0.229 . . . . 10.0 110.867 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -51.86 -56.6 13.04 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.567 ' O ' HG23 ' B' ' 64' ' ' VAL . 11.5 pt-20 -60.53 -47.09 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.808 0.299 . . . . 10.0 111.808 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.32 -47.44 85.93 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.38 . . . . 10.0 110.974 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -66.14 -40.12 90.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.807 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.07 -53.72 43.25 Favored Glycine 0 C--N 1.331 0.3 0 CA-C-N 116.093 -0.503 . . . . 10.0 112.857 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.608 ' HB ' HD22 ' A' ' 16' ' ' LEU . 14.1 t -62.31 -41.7 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 120.979 0.419 . . . . 10.0 110.119 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.2 tp -58.25 -52.44 65.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.453 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.463 ' HB3' HD11 ' A' ' 73' ' ' LEU . 49.6 mt -60.36 -48.71 80.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.331 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -50.34 -53.79 26.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 10.0 111.918 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.606 ' HB3' HD12 ' A' ' 14' ' ' ILE . 65.5 mm-40 -69.79 -47.32 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.015 -0.538 . . . . 10.0 111.933 -178.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.681 ' HB3' HD22 ' A' ' 66' ' ' LEU . 59.9 mt -59.91 -44.29 94.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.904 0.335 . . . . 10.0 111.904 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.16 -36.48 93.02 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.466 -0.873 . . . . 10.0 111.289 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.46 -28.39 61.02 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.699 0.285 . . . . 10.0 111.153 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 44.8 mmtt -65.45 -24.46 67.18 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 111.968 0.359 . . . . 10.0 111.968 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.647 HD11 ' HB3' ' A' ' 66' ' ' LEU . 23.2 mt -88.85 -4.28 58.52 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.722 -0.391 . . . . 10.0 111.53 -179.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.644 -0.694 . . . . 10.0 110.116 179.35 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . 0.415 H2'' ' HB3' ' A' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 101.643 -0.755 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C3'-C2'-C1' 101.459 -0.886 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . 0.457 " H1'" ' O ' ' A' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 O4'-C1'-C2' 104.331 -1.608 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.698 ' OP1' " H4'" ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 O4'-C4'-C3' 103.613 -1.987 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.626 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C4'-C3' 103.587 -2.013 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.789 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.858 0 C5'-C4'-O4' 113.075 2.297 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.989 0 C3'-C2'-C1' 101.391 -0.935 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . 0.609 ' OP2' " H4'" ' C' ' 11' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 101.3 -1.0 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.968 0 C3'-C2'-C1' 101.805 -0.639 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.457 " H1'" ' O ' ' B' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.409 -0.849 0 O4'-C1'-C2' 104.348 -1.593 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.741 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 O4'-C4'-C3' 103.542 -2.058 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.562 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.869 0 O4'-C4'-C3' 103.762 -1.838 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.805 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.933 0 C5'-C4'-O4' 113.133 2.333 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.454 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.425 -0.954 0 C3'-C2'-C1' 101.133 -1.119 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mmt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.976 0.417 . . . . 10.0 110.265 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.33 172.17 6.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.273 -0.421 . . . . 10.0 109.917 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.581 ' OD2' ' HG2' ' A' ' 4' ' ' LYS . 32.2 t70 -76.86 -57.0 4.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.011 0.434 . . . . 10.0 110.001 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.581 ' HG2' ' OD2' ' A' ' 3' ' ' ASP . 38.5 mmtm -135.42 95.38 3.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.873 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.754 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 23.9 tp -64.52 141.76 58.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.801 0.334 . . . . 10.0 110.532 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -77.21 131.7 38.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.221 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.531 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 12.2 p90 -155.43 174.25 15.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.501 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.552 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.1 tp10 -155.52 127.07 7.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.908 179.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.427 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.6 mt -81.54 111.81 18.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.141 0.496 . . . . 10.0 109.727 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.447 HG13 ' HB3' ' A' ' 37' ' ' PRO . 29.8 mm -80.28 -50.89 16.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.506 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -159.86 130.31 5.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.418 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -74.44 142.61 44.92 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 73.4 mt -110.64 -75.18 0.63 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.294 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.713 HD12 ' HB3' ' B' ' 68' ' ' GLU . 27.8 mm -132.45 140.96 46.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.227 0.537 . . . . 10.0 112.146 -177.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.86 123.58 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 107.962 -1.125 . . . . 10.0 107.962 177.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.598 HD22 ' HB ' ' B' ' 64' ' ' VAL . 31.0 mt -94.65 -81.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.531 -0.468 . . . . 10.0 112.208 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 m -176.34 -168.38 0.25 Allowed 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.427 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -106.6 147.56 29.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.754 179.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -83.61 -172.78 4.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.19 -26.22 68.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.819 0.819 . . . . 10.0 109.911 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.436 ' HG2' ' C2 ' ' C' ' 1' ' ' ' DT' . 20.2 mttt -88.67 -0.6 57.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.739 -1.118 . . . . 10.0 111.025 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.76 5.1 81.86 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.619 -0.8 . . . . 10.0 111.5 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.427 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 40.7 m0 -62.41 106.76 0.8 Allowed 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.866 0.365 . . . . 10.0 111.187 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' ' HA ' ' A' ' 43' ' ' THR . 9.5 tpp85 -82.94 100.06 10.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.551 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.683 ' HG2' HG22 ' A' ' 43' ' ' THR . 92.3 mttt -81.39 116.57 21.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.881 0.372 . . . . 10.0 110.56 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -132.97 152.24 51.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.084 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.656 HD13 ' HB ' ' A' ' 41' ' ' ILE . 46.3 tp -121.28 108.16 13.39 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 107.79 -1.189 . . . . 10.0 107.79 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -132.17 159.57 38.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 10.0 110.794 -178.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -96.9 113.65 25.2 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.284 -1.006 . . . . 10.0 108.284 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.427 HG12 ' HA ' ' A' ' 9' ' ' ILE . 11.4 m -127.37 158.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.776 0.322 . . . . 10.0 110.894 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.552 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -95.83 125.03 40.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.633 179.103 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.9 m0 -64.23 107.61 1.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.674 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 62.2 m-80 61.21 31.12 19.54 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.513 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.9 t0 66.33 17.08 10.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.056 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.82 -85.08 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.087 -0.383 . . . . 10.0 111.818 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -96.18 122.61 57.54 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 111.922 0.342 . . . . 10.0 111.922 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.504 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 71.7 Cg_endo -77.27 125.3 7.7 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.067 2.511 . . . . 10.0 111.676 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -143.35 167.98 20.88 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -93.96 126.38 39.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.209 -0.293 . . . . 10.0 110.209 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.45 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.9 t70 -138.27 133.2 32.81 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.656 ' HB ' HD13 ' A' ' 27' ' ' LEU . 14.5 tt -108.2 121.25 60.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.353 0.597 . . . . 10.0 109.956 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.557 HH21 H2'' ' C' ' 4' ' ' ' DT' . 2.9 mtt85 -144.44 -179.84 6.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.234 -177.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.683 HG22 ' HG2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -123.73 145.38 49.05 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.688 179.267 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.5 m95 -117.48 168.44 10.38 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.96 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.1 m -66.79 157.74 82.68 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 178.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -51.7 -31.7 42.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.093 2.529 . . . . 10.0 113.28 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -107.5 11.92 28.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.226 0.536 . . . . 10.0 110.459 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 54.3 m80 59.03 25.36 13.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.949 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -73.84 -39.67 63.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.734 0.302 . . . . 10.0 111.084 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -133.51 175.42 9.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.316 0.579 . . . . 10.0 111.087 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.423 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -140.43 172.78 12.25 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.967 -1.015 . . . . 10.0 110.497 -178.31 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.692 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -138.44 -161.55 8.85 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.583 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -97.77 146.0 25.82 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 122.279 -0.542 . . . . 10.0 112.331 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.443 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -143.15 -126.99 2.08 Favored Glycine 0 CA--C 1.519 0.299 0 N-CA-C 111.097 -0.801 . . . . 10.0 111.097 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 tt -146.77 142.93 20.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 117.888 0.844 . . . . 10.0 111.519 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.0 144.66 30.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.785 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.1 mt -123.77 131.38 53.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.573 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -77.92 171.67 14.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.943 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -64.54 -46.54 82.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.506 0.193 . . . . 10.0 111.248 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.17 -43.8 95.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.231 0.539 . . . . 10.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.413 ' HB3' HD13 ' B' ' 16' ' ' LEU . 74.0 mt-10 -65.28 -52.66 52.8 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.113 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 66' ' ' LEU . 21.1 t80 -56.25 -43.72 78.98 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.343 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.68 -54.11 39.75 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.14 -0.552 . . . . 10.0 112.729 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 89.4 t -62.22 -42.47 95.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.768 0.318 . . . . 10.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.461 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 14.9 tp -58.53 -52.58 65.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.402 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.704 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.4 mt -61.87 -46.05 91.13 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.612 -0.267 . . . . 10.0 111.483 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -51.54 -52.82 43.93 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 123.456 0.473 . . . . 10.0 111.194 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.538 ' CB ' HD12 ' B' ' 14' ' ' ILE . 70.6 mm-40 -68.68 -46.75 68.23 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.711 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 79.9 mt -60.14 -43.67 95.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.683 0.277 . . . . 10.0 111.411 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.61 -33.99 88.73 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.72 -0.753 . . . . 10.0 111.346 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -73.98 -28.37 61.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.882 0.373 . . . . 10.0 110.786 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 74.1 mmtt -67.64 -27.5 66.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.967 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' B' ' 66' ' ' LEU . 42.0 mt -90.0 -5.25 56.85 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.735 0.272 . . . . 10.0 111.735 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.656 -0.687 . . . . 10.0 110.665 -179.705 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.931 0.396 . . . . 10.0 109.976 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.53 168.18 9.43 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.448 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 36.1 t70 -76.49 -53.32 8.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.055 0.455 . . . . 10.0 110.078 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.448 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 38.2 mmtm -136.29 94.54 3.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.685 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.682 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 25.6 tp -65.4 139.26 58.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.856 0.36 . . . . 10.0 110.602 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.474 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 16.2 tppt? -75.58 130.69 39.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.57 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.626 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.6 p90 -153.94 174.3 14.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.196 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.524 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.8 tp10 -155.11 122.37 5.56 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.806 179.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.498 ' HA ' HG12 ' B' ' 30' ' ' VAL . 44.7 mt -77.65 109.83 12.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' B' ' 37' ' ' PRO . 28.6 mm -79.01 -51.83 16.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.664 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -158.87 127.97 5.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.265 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -72.26 145.06 48.16 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 53.1 mt -113.29 -72.12 0.72 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.492 -0.483 . . . . 10.0 111.488 -179.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.538 HD12 ' CB ' ' A' ' 68' ' ' GLU . 18.9 mm -133.17 140.63 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 10.0 112.052 -177.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' B' ' 26' ' ' GLU . 4.6 p -123.48 123.77 68.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 107.969 -1.123 . . . . 10.0 107.969 177.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 61' ' ' GLU . 30.5 mt -94.92 -81.19 0.4 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.473 -0.491 . . . . 10.0 112.012 -177.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.8 m -178.46 -168.42 0.15 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 -179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.7 mp0 -106.87 147.57 29.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 10.0 110.271 179.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -83.69 -168.0 1.94 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.141 -0.482 . . . . 10.0 109.75 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.1 -23.45 64.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.282 0.563 . . . . 10.0 110.356 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -91.78 1.03 57.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.419 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.82 4.66 82.19 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.51 -0.852 . . . . 10.0 111.636 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 40.1 m0 -61.94 106.16 0.67 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.742 0.306 . . . . 10.0 110.973 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' B' ' 43' ' ' THR . 7.9 tpp85 -83.02 100.43 10.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.809 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.713 ' HG2' HG22 ' B' ' 43' ' ' THR . 93.3 mttt -81.03 116.97 21.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 10.0 110.891 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.443 ' HG2' HG23 ' B' ' 15' ' ' VAL . 66.9 mt-10 -132.57 150.39 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.937 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.632 HD13 ' HB ' ' B' ' 41' ' ' ILE . 41.2 tp -120.14 107.94 13.63 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.95 -1.13 . . . . 10.0 107.95 178.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -133.27 158.0 44.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.939 0.4 . . . . 10.0 111.159 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -94.93 114.0 25.79 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.414 -0.958 . . . . 10.0 108.414 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.498 HG12 ' HA ' ' B' ' 9' ' ' ILE . 13.2 m -128.16 156.15 40.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.362 . . . . 10.0 110.883 -178.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.524 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.7 OUTLIER -95.11 125.58 39.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.033 0.444 . . . . 10.0 110.626 179.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 10.5 m0 -64.24 110.11 2.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.956 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.474 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.7 m-80 60.6 28.71 18.41 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.667 0.604 . . . . 10.0 110.356 -178.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 40.4 t0 62.66 32.22 16.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.037 -0.983 . . . . 10.0 110.214 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.62 -82.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.025 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -98.16 122.38 54.35 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-O 120.646 0.26 . . . . 10.0 111.515 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.505 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 70.3 Cg_endo -77.12 121.78 5.92 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.809 2.339 . . . . 10.0 111.654 178.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.407 ' HD2' ' CG2' ' B' ' 56' ' ' THR . 19.7 ttmm -139.75 167.5 21.96 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.337 -0.616 . . . . 10.0 109.337 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -95.04 126.83 40.65 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.467 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.8 t70 -138.15 132.82 32.52 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.611 -0.515 . . . . 10.0 109.611 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.632 ' HB ' HD13 ' B' ' 27' ' ' LEU . 11.9 tt -106.44 121.76 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.183 0.516 . . . . 10.0 109.73 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.546 HH21 H2'' ' C' ' 14' ' ' ' DT' . 3.0 mtt85 -144.87 178.48 7.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.268 0.556 . . . . 10.0 111.599 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.713 HG22 ' HG2' ' B' ' 25' ' ' LYS . 0.1 OUTLIER -121.86 145.0 48.51 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.573 -0.739 . . . . 10.0 109.743 179.453 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -117.73 167.09 11.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.673 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 16.6 m -66.35 157.98 79.69 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.504 -0.554 . . . . 10.0 109.504 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -51.48 -33.24 46.48 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.975 2.45 . . . . 10.0 112.908 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -105.1 11.29 33.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.102 0.477 . . . . 10.0 110.91 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.2 m80 57.76 27.66 14.75 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.38 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.23 -39.85 59.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.825 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -134.68 175.17 9.79 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 10.0 111.132 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . 0.423 ' N ' ' SD ' ' B' ' 51' ' ' MET . 0.0 OUTLIER -141.19 172.63 12.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.257 -0.883 . . . . 10.0 110.363 -178.111 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.667 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -138.63 -159.97 8.25 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.566 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -97.41 146.47 25.16 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.184 -0.598 . . . . 10.0 112.241 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.426 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -142.4 -129.02 2.34 Favored Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 tt -147.48 140.9 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 117.666 0.733 . . . . 10.0 111.22 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.407 ' CG2' ' HD2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -100.83 147.92 25.54 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.16 -179.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 87.6 mt -126.52 132.94 51.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.383 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.3 m -79.92 169.52 17.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.146 -0.316 . . . . 10.0 110.146 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.27 -47.95 83.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 10.0 111.145 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.645 ' O ' HG23 ' B' ' 64' ' ' VAL . 8.5 pt-20 -58.57 -44.31 89.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.608 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.463 ' HG3' ' HG3' ' B' ' 60' ' ' GLU . 65.6 mt-10 -66.48 -52.73 43.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.023 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.49 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 2.1 t80 -57.16 -41.56 79.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.858 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.75 -53.46 45.79 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.27 -0.491 . . . . 10.0 112.84 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.645 HG23 ' O ' ' B' ' 60' ' ' GLU . 15.6 t -62.97 -43.51 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.877 0.37 . . . . 10.0 110.503 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 19.1 tp -58.33 -51.98 67.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.358 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.573 ' HB3' HD11 ' A' ' 73' ' ' LEU . 62.1 mt -60.1 -49.61 76.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.812 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -50.74 -54.62 21.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.661 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.713 ' HB3' HD12 ' A' ' 14' ' ' ILE . 39.6 mm-40 -67.42 -47.57 69.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.053 -0.521 . . . . 10.0 112.027 -178.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.643 ' HB3' HD22 ' A' ' 66' ' ' LEU . 72.5 mt -61.75 -42.12 98.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.5 0.19 . . . . 10.0 111.455 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.73 -37.37 94.71 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -72.02 -28.81 63.62 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.023 0.44 . . . . 10.0 110.911 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 70.5 mmtt -64.44 -32.27 73.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.065 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.539 HD11 ' CB ' ' A' ' 66' ' ' LEU . 24.9 mt -90.66 6.06 45.49 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.794 -0.622 . . . . 10.0 109.788 179.209 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . 0.436 ' C2 ' ' HG2' ' A' ' 21' ' ' LYS . . . . . . . . 0 C2'--C1' 1.512 -0.659 0 C3'-C2'-C1' 101.63 -0.764 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 101.596 -0.789 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.014 0 O4'-C1'-C2' 104.266 -1.668 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.754 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.793 0 O4'-C4'-C3' 103.47 -2.13 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.566 H5'' HD13 ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.52 -0.757 0 O4'-C4'-C3' 103.361 -2.239 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.825 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.885 0 C5'-C4'-O4' 113.218 2.386 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.924 0 C3'-C2'-C1' 101.111 -1.135 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.969 0 C3'-C2'-C1' 101.316 -0.989 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.997 0 C3'-C2'-C1' 101.785 -0.653 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 O4'-C1'-C2' 104.344 -1.597 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.682 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.812 0 O4'-C4'-C3' 103.531 -2.069 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.567 H5'' HD13 ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.427 -0.838 0 O4'-C4'-C3' 103.629 -1.971 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.838 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.432 0.932 0 C5'-C4'-O4' 113.056 2.285 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 C3'-C2'-C1' 101.044 -1.183 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 mmt . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 120.889 0.376 . . . . 10.0 110.175 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 168.29 10.45 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.115 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.96 -58.22 3.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -135.95 105.19 5.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 178.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.748 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 38.0 tp -78.26 143.28 37.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 10.0 110.423 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -78.63 139.41 38.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.968 0.413 . . . . 10.0 111.268 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.478 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 12.4 p90 -162.84 175.92 10.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.608 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.44 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 10.9 tp10 -160.13 131.14 5.73 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.8 mt -80.38 112.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.785 0.326 . . . . 10.0 110.208 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.2 mm -85.48 -39.47 13.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.657 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -165.8 127.25 1.91 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.571 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.55 142.63 37.2 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 178.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.465 ' O ' HD13 ' A' ' 14' ' ' ILE . 72.2 mt -111.43 -74.47 0.64 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.559 -0.457 . . . . 10.0 111.627 -178.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.668 HD12 ' HB3' ' B' ' 68' ' ' GLU . 28.1 mm -129.41 144.57 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.143 0.497 . . . . 10.0 111.855 -177.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.401 HG23 ' HG2' ' A' ' 26' ' ' GLU . 2.6 p -128.56 126.52 65.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 108.308 -0.997 . . . . 10.0 108.308 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.653 HD13 ' HA ' ' B' ' 61' ' ' GLU . 36.0 mt -95.33 -80.57 0.41 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.704 -0.398 . . . . 10.0 111.249 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 m 175.82 -173.93 0.09 Allowed 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.378 0.671 . . . . 10.0 109.487 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.492 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 1.8 mp0 -99.58 151.86 20.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.293 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -94.18 -173.33 3.06 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.07 -26.4 67.61 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.639 0.733 . . . . 10.0 110.811 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -89.17 3.09 53.09 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.022 -0.99 . . . . 10.0 110.719 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.36 -1.54 88.55 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.817 -0.706 . . . . 10.0 111.466 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.499 ' HB3' ' CG2' ' A' ' 43' ' ' THR . 40.2 m0 -56.13 107.05 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.987 0.366 . . . . 10.0 111.987 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 tpp85 -80.18 108.74 14.03 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.537 ' HG2' ' CG2' ' A' ' 43' ' ' THR . 78.9 mttt -85.46 112.0 20.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.292 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.401 ' HG2' HG23 ' A' ' 15' ' ' VAL . 50.3 mt-10 -138.59 155.44 48.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.667 0.746 . . . . 10.0 112.122 -179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.801 HD13 ' HB ' ' A' ' 41' ' ' ILE . 36.4 tp -127.7 110.4 12.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.668 -1.151 . . . . 10.0 108.393 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -135.04 162.77 31.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.05 0.453 . . . . 10.0 111.795 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -94.84 114.72 26.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 178.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 16.4 m -129.54 156.74 42.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.974 0.416 . . . . 10.0 111.246 -179.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 1.5 p -96.83 122.3 39.65 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.04 0.447 . . . . 10.0 110.627 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -63.92 111.23 2.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.962 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 58.93 27.97 16.95 Favored 'General case' 0 N--CA 1.463 0.179 0 O-C-N 123.806 0.691 . . . . 10.0 110.44 -178.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.1 t70 64.76 25.64 12.97 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.232 -0.895 . . . . 10.0 110.891 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.69 -80.22 0.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.335 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -98.32 123.74 49.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.541 0.21 . . . . 10.0 111.41 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 31' ' ' SER . 74.4 Cg_endo -81.05 123.86 4.72 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.997 2.464 . . . . 10.0 111.685 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -143.85 168.69 19.35 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.87 136.77 32.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.445 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t0 -147.58 129.33 15.18 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.801 ' HB ' HD13 ' A' ' 27' ' ' LEU . 11.1 tt -108.73 122.62 63.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.251 0.548 . . . . 10.0 109.579 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.596 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.1 mtt85 -146.45 176.16 10.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.42 0.629 . . . . 10.0 111.977 -177.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.537 ' CG2' ' HG2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -117.38 131.28 56.8 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 114.799 -1.091 . . . . 10.0 109.718 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.0 m0 -117.26 177.52 4.7 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.757 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -72.96 155.39 90.52 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.57 -24.07 70.19 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.195 1.93 . . . . 10.0 112.068 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -98.05 -0.86 43.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.861 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.2 m170 61.34 20.88 11.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.405 -0.816 . . . . 10.0 110.703 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.42 ' H ' ' HG2' ' A' ' 49' ' ' GLU . 12.2 pt-20 -71.7 -39.34 70.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.033 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -135.35 174.3 10.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.224 0.535 . . . . 10.0 111.194 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.403 ' HG3' ' C2 ' ' C' ' 4' ' ' ' DT' . 0.0 OUTLIER -140.74 171.79 13.61 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.183 -0.917 . . . . 10.0 110.407 -177.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.665 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -137.91 -161.74 8.99 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.637 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.5 mttp -99.94 145.87 27.33 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -145.41 -121.01 1.38 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 111.08 -0.808 . . . . 10.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 12.7 tt -148.84 142.55 18.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 117.521 0.66 . . . . 10.0 111.14 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -101.73 136.84 40.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.833 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.4 mt -117.09 120.48 38.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.925 0.393 . . . . 10.0 110.27 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.502 ' HB3' ' HG2' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -80.6 172.49 13.69 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.502 179.586 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -58.22 -43.05 87.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 10.0 111.503 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.572 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 9.2 pt-20 -54.44 -47.38 72.95 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.39 0.614 . . . . 10.0 110.509 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.572 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 26.7 mt-10 -68.23 -58.64 4.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.052 -0.977 . . . . 10.0 111.326 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.629 ' CE2' HD11 ' A' ' 66' ' ' LEU . 10.1 t80 -49.82 -44.83 49.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.401 -0.818 . . . . 10.0 111.867 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -60.87 -58.5 13.42 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.229 -0.51 . . . . 10.0 113.181 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -65.17 -40.93 90.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 120.883 0.373 . . . . 10.0 111.296 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.477 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 20.1 tp -58.24 -53.84 53.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.958 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.629 HD11 ' CE2' ' A' ' 62' ' ' PHE . 19.1 mt -61.92 -43.84 98.01 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.106 -0.237 . . . . 10.0 111.356 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.1 tttm -50.76 -53.31 32.75 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 123.616 0.572 . . . . 10.0 111.07 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.514 ' CB ' HD12 ' B' ' 14' ' ' ILE . 25.2 mm-40 -72.07 -44.56 63.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.706 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 44.0 mt -59.43 -44.0 92.98 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.424 0.157 . . . . 10.0 111.424 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.4 94.67 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.459 -0.876 . . . . 10.0 110.987 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -68.75 -28.15 66.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.702 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 72.3 mmtt -68.54 -30.7 69.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.285 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.499 HD11 ' HB3' ' B' ' 66' ' ' LEU . 19.4 mt -88.49 2.56 52.62 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.243 -0.183 . . . . 10.0 111.419 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.471 -0.776 . . . . 10.0 110.309 179.857 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.3 mmt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.915 0.388 . . . . 10.0 110.18 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.24 163.47 13.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.322 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.426 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 4.6 t70 -66.32 -60.37 2.83 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.426 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 35.1 mmtm -132.5 104.64 6.79 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.751 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 37.3 tp -77.56 142.71 38.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.814 0.34 . . . . 10.0 110.692 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -79.36 136.27 36.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.078 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.564 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 9.3 p90 -160.11 174.77 13.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.681 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.449 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 13.5 tp10 -158.64 126.57 5.14 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.059 -0.348 . . . . 10.0 110.059 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.403 ' HA ' HG12 ' B' ' 30' ' ' VAL . 71.9 mt -76.0 114.55 16.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.064 0.459 . . . . 10.0 110.156 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 32.0 mm -86.99 -41.26 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.428 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -164.48 127.53 2.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.771 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -76.52 142.89 40.72 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 63.4 mt -111.75 -72.55 0.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.521 -0.472 . . . . 10.0 111.861 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.514 HD12 ' CB ' ' A' ' 68' ' ' GLU . 21.5 mm -131.5 144.2 38.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 10.0 111.496 -177.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.415 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -129.16 123.36 58.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.355 -0.98 . . . . 10.0 108.355 177.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 26.5 mt -92.3 -80.81 0.36 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.905 -0.318 . . . . 10.0 111.445 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m 176.59 -172.05 0.09 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.302 0.641 . . . . 10.0 109.386 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.447 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 1.9 mp0 -101.34 150.87 22.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . 0.4 ' CG ' ' H ' ' B' ' 20' ' ' ALA . 18.0 t-20 -90.91 -174.51 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.781 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . 0.4 ' H ' ' CG ' ' B' ' 19' ' ' ASN . . . -63.82 -23.83 67.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.453 0.644 . . . . 10.0 110.596 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . 0.44 ' HD3' H2'' ' C' ' 11' ' ' ' DT' . 24.6 mttt -91.06 1.49 57.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.287 -0.869 . . . . 10.0 110.314 179.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.34 -1.21 87.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.389 -178.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.511 ' HB3' ' CG2' ' B' ' 43' ' ' THR . 40.3 m0 -56.68 107.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.943 0.349 . . . . 10.0 111.943 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.61 109.58 15.27 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . 0.445 ' HG2' ' CG2' ' B' ' 43' ' ' THR . 80.8 mttt -86.36 111.58 20.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.611 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.415 ' HG2' HG23 ' B' ' 15' ' ' VAL . 50.2 mt-10 -138.21 157.14 46.88 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.568 0.699 . . . . 10.0 112.138 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.784 HD13 ' HB ' ' B' ' 41' ' ' ILE . 35.4 tp -128.88 111.02 12.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.742 -1.117 . . . . 10.0 108.192 178.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -135.57 161.03 36.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.037 0.446 . . . . 10.0 111.435 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 ttm-85 -93.03 114.67 27.29 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.35 -0.981 . . . . 10.0 108.35 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' B' ' 9' ' ' ILE . 18.3 m -128.87 154.99 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.948 0.404 . . . . 10.0 111.076 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.499 ' HA ' ' HA ' ' B' ' 37' ' ' PRO . 1.5 p -95.63 122.72 38.69 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.972 0.415 . . . . 10.0 110.513 179.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -63.99 112.39 2.93 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.82 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 57.58 28.13 15.18 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.708 0.63 . . . . 10.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 62.95 30.45 16.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.963 -1.017 . . . . 10.0 110.884 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -111.77 -79.07 0.58 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.102 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.47 ' OE2' H2'' ' C' ' 17' ' ' ' DT' . 35.6 tt0 -99.05 122.06 53.66 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.532 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 65.7 Cg_endo -79.78 122.52 4.94 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.716 2.277 . . . . 10.0 111.709 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -142.99 166.57 24.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -87.41 135.65 33.25 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 10.5 t0 -147.41 128.57 14.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.784 ' HB ' HD13 ' B' ' 27' ' ' LEU . 10.1 tt -107.34 123.25 62.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.517 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.0 mtt85 -146.23 175.05 10.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.494 0.664 . . . . 10.0 112.119 -177.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.511 ' CG2' ' HB3' ' B' ' 23' ' ' TRP . 0.0 OUTLIER -117.45 131.59 56.71 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.728 -1.124 . . . . 10.0 109.887 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 18.0 m0 -117.56 177.99 4.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.56 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 3.9 m -74.21 155.44 88.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.17 -31.21 89.87 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.073 1.849 . . . . 10.0 112.145 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -90.14 -3.8 57.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.195 179.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 m170 64.15 24.7 13.52 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.489 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.68 -39.64 61.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.138 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -133.97 174.3 10.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.136 0.493 . . . . 10.0 110.834 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.74 168.82 18.94 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.573 -177.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.587 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -135.04 -163.79 10.23 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.704 -0.76 . . . . 10.0 112.664 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mttp -98.59 144.84 27.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.38 0.511 . . . . 10.0 112.38 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -143.52 -118.54 1.31 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.8 tt -152.56 142.35 14.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.413 0.607 . . . . 10.0 110.919 179.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.6 m -102.44 135.42 44.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.475 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 68.8 mt -115.75 121.23 41.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.871 0.367 . . . . 10.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.9 m -80.45 174.01 12.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.582 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -59.26 -40.78 87.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.838 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' B' ' 61' ' ' GLU . 8.5 pt-20 -55.55 -46.67 77.11 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.606 0.717 . . . . 10.0 110.432 178.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.653 ' HA ' HD13 ' A' ' 16' ' ' LEU . 31.6 mt-10 -68.54 -58.62 4.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.021 -0.991 . . . . 10.0 111.202 -179.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -53.83 -39.18 65.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.822 -178.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.32 -59.65 9.59 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.918 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.589 ' HB ' HD22 ' A' ' 16' ' ' LEU . 8.9 t -67.19 -41.04 86.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.627 0.251 . . . . 10.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.58 -53.59 56.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.094 -179.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.499 ' HB3' HD11 ' A' ' 73' ' ' LEU . 45.3 mt -59.01 -49.12 79.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.238 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -50.19 -54.19 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.662 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.668 ' HB3' HD12 ' A' ' 14' ' ' ILE . 21.7 mm-40 -69.38 -46.53 66.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.856 -0.611 . . . . 10.0 112.056 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.615 ' HB3' HD22 ' A' ' 66' ' ' LEU . 46.8 mt -60.57 -43.86 96.82 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.04 94.11 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.717 -0.953 . . . . 10.0 110.717 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.19 -23.6 61.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.365 -0.418 . . . . 10.0 111.185 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 72.6 mmtt -70.06 -29.82 66.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.185 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.421 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.5 mt -90.31 4.52 50.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.563 0.22 . . . . 10.0 111.411 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.907 -0.568 . . . . 10.0 109.866 179.071 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 C3'-C2'-C1' 101.449 -0.894 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.453 ' H73' ' HB ' ' A' ' 43' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 101.404 -0.926 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . 0.418 " O5'" H2'' ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.956 0 O4'-C1'-C2' 104.182 -1.744 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.748 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C4'-C3' 103.508 -2.092 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.596 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.899 0 O4'-C4'-C3' 103.56 -2.04 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.79 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.822 0 C5'-C4'-O4' 112.945 2.216 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.932 0 C3'-C2'-C1' 101.373 -0.948 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . 0.44 H2'' ' HD3' ' B' ' 21' ' ' LYS . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 101.282 -1.013 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 C3'-C2'-C1' 101.832 -0.62 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.45 ' H6 ' " H2'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.924 0 O4'-C1'-C2' 104.352 -1.589 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.751 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C4'-C3' 103.502 -2.098 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.517 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.421 -1.158 0 O4'-C4'-C3' 103.706 -1.894 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.829 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.829 0 C5'-C4'-O4' 113.039 2.274 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.47 H2'' ' OE2' ' B' ' 36' ' ' GLU . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 C3'-C2'-C1' 100.941 -1.257 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.6 mmm . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 120.869 0.366 . . . . 10.0 110.228 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.44 154.68 18.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.903 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.475 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 24.3 t70 -60.15 -52.8 63.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.124 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.475 ' HD3' ' O ' ' A' ' 3' ' ' ASP . 24.4 mmtm -137.8 106.41 5.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.859 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.794 ' HB3' ' H71' ' C' ' 4' ' ' ' DT' . 31.0 tp -82.93 137.3 34.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.081 -0.34 . . . . 10.0 110.081 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 33' ' ' ASN . 17.8 tppt? -73.23 134.52 44.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.279 -0.418 . . . . 10.0 110.889 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.41 ' CD1' ' H73' ' C' ' 4' ' ' ' DT' . 8.7 p90 -159.83 168.29 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.257 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.509 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 7.5 tp10 -147.49 135.22 21.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.145 178.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.465 ' HA ' HG12 ' A' ' 30' ' ' VAL . 53.7 mt -83.68 106.69 14.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.433 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.448 HG13 ' HB3' ' A' ' 37' ' ' PRO . 37.2 mm -77.11 -56.51 7.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.937 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -157.83 126.79 5.71 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.062 -179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -73.46 142.61 46.85 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 60.1 mt -110.69 -75.65 0.62 Allowed 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.368 -0.533 . . . . 10.0 111.539 -178.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.635 HD12 ' HB3' ' B' ' 68' ' ' GLU . 29.9 mm -131.03 136.95 56.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.162 0.506 . . . . 10.0 111.741 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.542 HG23 ' HG2' ' A' ' 26' ' ' GLU . 3.3 p -117.23 123.18 71.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.246 -1.02 . . . . 10.0 108.246 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -90.45 -80.87 0.32 Allowed 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.764 -0.374 . . . . 10.0 111.308 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.3 m 176.59 -179.13 0.17 Allowed 'General case' 0 C--O 1.235 0.34 0 C-N-CA 122.952 0.501 . . . . 10.0 110.006 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' A' ' 23' ' ' TRP . 45.1 mp0 -95.09 164.46 12.86 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.02 -167.69 1.25 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.307 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.48 -25.71 68.14 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 10.0 110.556 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -91.56 0.24 57.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.146 -0.933 . . . . 10.0 110.728 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.66 -1.56 88.57 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.811 -0.709 . . . . 10.0 111.492 -178.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.508 ' O ' ' HA ' ' A' ' 18' ' ' GLU . 41.0 m0 -53.05 105.64 0.13 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.569 ' O ' ' HA ' ' A' ' 43' ' ' THR . 17.0 tpp85 -80.37 100.16 8.3 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.16 -0.681 . . . . 10.0 109.16 178.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -81.57 112.02 18.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.675 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.542 ' HG2' HG23 ' A' ' 15' ' ' VAL . 54.3 mt-10 -137.98 152.4 48.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.372 0.606 . . . . 10.0 111.58 -179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.78 HD13 ' HB ' ' A' ' 41' ' ' ILE . 34.2 tp -122.99 107.65 12.05 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -134.28 157.76 45.5 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.478 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -97.12 114.32 25.99 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.465 HG12 ' HA ' ' A' ' 9' ' ' ILE . 15.7 m -125.41 162.04 28.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.795 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.509 ' OG ' ' HB3' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -98.78 123.97 43.36 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.95 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -64.28 112.28 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.982 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.42 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 63.6 m-80 58.72 28.93 17.96 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.681 0.613 . . . . 10.0 110.447 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.7 t70 64.23 27.69 13.91 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.128 -0.942 . . . . 10.0 110.648 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -112.47 -82.61 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.366 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 31' ' ' SER . 35.7 tt0 -89.19 120.5 69.82 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.556 -178.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.448 ' HB3' HG13 ' A' ' 10' ' ' ILE . 33.8 Cg_endo -82.93 120.64 3.06 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.664 2.243 . . . . 10.0 111.111 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.441 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 16.3 ttpt -148.19 160.73 42.63 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.216 -0.29 . . . . 10.0 110.216 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -81.63 140.0 34.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.628 -0.26 . . . . 10.0 110.692 -178.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.407 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 9.8 t70 -150.4 133.9 16.49 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.78 ' HB ' HD13 ' A' ' 27' ' ' LEU . 10.6 tt -111.86 122.75 66.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.118 0.485 . . . . 10.0 109.92 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.578 ' NH1' ' H3 ' ' C' ' 5' ' ' ' DT' . 3.4 mtt85 -148.14 171.19 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.495 -177.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.569 ' HA ' ' O ' ' A' ' 24' ' ' ARG . 1.7 p -121.31 134.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -118.76 177.97 4.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.541 0.21 . . . . 10.0 110.872 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.7 m -63.38 151.81 86.59 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.837 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.04 -30.73 83.27 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.528 2.152 . . . . 10.0 111.88 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -91.11 -3.03 57.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.253 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 64.25 24.83 13.44 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.716 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.37 -34.05 61.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.008 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -141.33 174.45 10.53 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.347 0.594 . . . . 10.0 111.722 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.421 ' O ' " H1'" ' C' ' 3' ' ' ' DT' . 0.0 OUTLIER -127.93 172.62 10.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.761 -1.109 . . . . 10.0 110.944 -178.244 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.572 ' O ' " H1'" ' C' ' 4' ' ' ' DT' . . . -140.58 -171.71 12.6 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 121.062 -0.59 . . . . 10.0 112.475 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 32.8 mttp -99.0 144.33 28.28 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 121.979 -0.718 . . . . 10.0 112.446 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.4 ' H ' ' CZ ' ' A' ' 42' ' ' ARG . . . -143.59 -120.38 1.47 Allowed Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.577 -1.009 . . . . 10.0 110.577 178.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 tt -149.18 142.65 18.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 117.513 0.656 . . . . 10.0 110.818 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.2 m -97.47 139.79 32.88 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.973 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.7 mt -115.8 118.77 33.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.913 0.387 . . . . 10.0 110.594 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -77.5 167.28 21.91 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.8 -39.88 86.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.779 0.323 . . . . 10.0 110.399 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.431 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 6.7 pt-20 -56.63 -46.93 80.68 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.253 178.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 31.5 mt-10 -67.81 -56.37 9.42 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.786 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.702 ' CE2' HD11 ' A' ' 66' ' ' LEU . 7.8 t80 -49.72 -47.95 50.29 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.029 0.831 . . . . 10.0 111.776 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.94 -56.46 25.19 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.39 -0.433 . . . . 10.0 113.382 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.1 t -67.28 -42.33 87.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.82 0.343 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 17.5 tp -58.53 -53.38 58.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.016 -178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.719 HD22 ' HB3' ' B' ' 69' ' ' LEU . 21.2 mt -61.26 -44.41 97.28 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.38 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.7 tttm -52.19 -53.49 42.69 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.046 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.619 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 54.5 mm-40 -70.09 -47.88 59.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.702 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.522 ' HB3' HD22 ' B' ' 66' ' ' LEU . 59.0 mt -58.27 -45.46 87.83 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.633 0.234 . . . . 10.0 111.633 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -64.3 -35.04 91.46 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.565 -0.826 . . . . 10.0 111.396 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -73.48 -28.72 62.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.491 -0.354 . . . . 10.0 110.859 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.619 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 52.1 mmtt -68.88 -23.4 64.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.986 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.588 HD11 ' HB3' ' B' ' 66' ' ' LEU . 27.3 mt -89.86 -14.35 34.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.868 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.851 -0.595 . . . . 10.0 110.462 -179.642 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 31.9 mmm . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.689 0.28 . . . . 10.0 110.605 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.72 161.04 13.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.44 ' OD2' ' HG2' ' B' ' 4' ' ' LYS . 23.2 t70 -66.79 -52.73 40.54 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.44 ' HG2' ' OD2' ' B' ' 3' ' ' ASP . 31.6 mmtm -136.98 104.95 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.031 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.779 ' HB3' ' H71' ' C' ' 14' ' ' ' DT' . 37.4 tp -82.18 133.67 35.27 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 33' ' ' ASN . 17.8 tppt? -72.47 133.14 44.69 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.072 0.463 . . . . 10.0 111.282 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.534 ' CD1' ' H73' ' C' ' 14' ' ' ' DT' . 8.2 p90 -158.35 170.02 23.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.554 179.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.483 ' HB3' ' OG ' ' B' ' 31' ' ' SER . 9.0 tp10 -147.32 133.64 19.55 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.532 ' HA ' HG12 ' B' ' 30' ' ' VAL . 50.9 mt -81.63 105.0 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.98 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 47.3 mm -75.34 -56.93 7.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.071 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -157.58 130.33 7.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.981 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.92 141.31 40.56 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.922 -0.77 . . . . 10.0 108.922 178.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' B' ' 27' ' ' LEU . 44.0 mt -110.27 -74.09 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.439 -0.504 . . . . 10.0 111.664 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.506 HD12 ' CB ' ' A' ' 68' ' ' GLU . 19.5 mm -130.29 136.79 57.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.046 0.45 . . . . 10.0 111.714 -177.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.468 HG23 ' HG2' ' B' ' 26' ' ' GLU . 2.6 p -118.48 120.45 64.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -87.43 -81.15 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.719 -0.392 . . . . 10.0 111.41 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m 176.07 -177.99 0.13 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.017 0.527 . . . . 10.0 109.922 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' B' ' 23' ' ' TRP . 36.7 mp0 -96.81 163.92 12.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.15 -166.61 1.13 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.461 -0.2 . . . . 10.0 110.461 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.85 -26.76 68.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.388 0.613 . . . . 10.0 110.89 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -92.04 0.41 57.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.322 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 83.51 -0.23 89.7 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.632 -0.794 . . . . 10.0 111.666 -178.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' TRP . . . . . 0.513 ' O ' ' HA ' ' B' ' 18' ' ' GLU . 41.0 m0 -52.72 106.28 0.15 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 112.03 0.382 . . . . 10.0 112.03 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.535 ' O ' ' HA ' ' B' ' 43' ' ' THR . 16.3 tpp85 -80.59 100.25 8.52 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -81.59 112.19 18.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.755 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.468 ' HG2' HG23 ' B' ' 15' ' ' VAL . 53.8 mt-10 -138.21 152.94 49.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.387 0.613 . . . . 10.0 111.811 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.753 HD13 ' HB ' ' B' ' 41' ' ' ILE . 36.8 tp -123.08 107.56 11.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.008 -1.108 . . . . 10.0 108.008 178.278 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -134.45 157.28 46.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.565 -0.289 . . . . 10.0 110.714 -178.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -96.67 114.97 26.66 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' B' ' 9' ' ' ILE . 19.4 m -126.69 160.99 34.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.665 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.483 ' OG ' ' HB3' ' B' ' 8' ' ' GLU . 0.2 OUTLIER -97.28 124.54 41.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.079 0.466 . . . . 10.0 111.094 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' TRP . . . . . 0.481 ' CH2' ' H72' ' C' ' 17' ' ' ' DT' . 11.5 m0 -64.46 111.75 2.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.008 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' B' ' 6' ' ' LYS . 64.4 m-80 58.4 30.63 19.9 Favored 'General case' 0 CA--C 1.521 -0.139 0 O-C-N 123.802 0.689 . . . . 10.0 110.361 -178.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 28.4 t0 61.0 33.01 19.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.986 -1.006 . . . . 10.0 110.565 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.46 -78.72 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.923 -0.58 . . . . 10.0 111.289 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -92.41 117.55 67.68 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.432 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' B' ' 31' ' ' SER . 72.4 Cg_endo -81.0 119.98 3.67 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.592 2.195 . . . . 10.0 111.279 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ttpt -148.36 161.62 41.2 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.035 -0.266 . . . . 10.0 110.436 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -81.17 139.53 35.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.876 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.412 ' OD1' ' HG3' ' B' ' 42' ' ' ARG . 9.7 t0 -150.71 132.61 15.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.753 ' HB ' HD13 ' B' ' 27' ' ' LEU . 9.8 tt -110.25 122.87 65.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-O 121.246 0.546 . . . . 10.0 110.193 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.532 ' NH1' ' H3 ' ' C' ' 15' ' ' ' DT' . 3.1 mtt85 -147.88 170.58 17.35 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.661 -177.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' B' ' 24' ' ' ARG . 2.5 p -120.53 134.17 55.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 m0 -118.03 177.75 4.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.789 -0.187 . . . . 10.0 110.973 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 2.0 m -66.11 151.04 96.15 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.675 -0.239 . . . . 10.0 110.372 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.61 -33.34 96.81 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.569 2.18 . . . . 10.0 111.793 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -87.15 -5.03 59.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.289 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 66.48 21.0 10.87 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.586 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -70.49 -37.87 74.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.956 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -137.79 174.17 10.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.495 0.664 . . . . 10.0 112.293 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.58 172.09 11.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.743 -1.117 . . . . 10.0 110.72 -178.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.52 ' O ' " H1'" ' C' ' 14' ' ' ' DT' . . . -140.14 -170.18 11.92 Favored Glycine 0 CA--C 1.52 0.386 0 C-N-CA 121.034 -0.603 . . . . 10.0 112.248 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -99.7 142.2 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.987 -0.714 . . . . 10.0 112.53 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.406 ' H ' ' CZ ' ' B' ' 42' ' ' ARG . . . -140.01 -120.64 1.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 110.209 -1.156 . . . . 10.0 110.209 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 11.3 tt -150.06 143.26 17.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.413 0.607 . . . . 10.0 110.565 179.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m -97.0 140.0 32.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.271 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 80.9 mt -116.5 117.71 30.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.845 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -76.22 166.67 23.13 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.22 -39.24 85.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 10.0 110.166 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . 0.416 ' HG3' ' N ' ' B' ' 61' ' ' GLU . 7.0 pt-20 -56.88 -44.98 82.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.44 -0.8 . . . . 10.0 110.381 177.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' B' ' 60' ' ' GLU . 33.8 mt-10 -69.63 -56.37 7.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.454 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.552 ' O ' ' HG ' ' B' ' 66' ' ' LEU . 1.2 t80 -52.25 -44.5 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.82 0.7 . . . . 10.0 111.332 -179.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.81 -55.44 30.85 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.907 -0.663 . . . . 10.0 113.128 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.8 t -68.99 -44.18 81.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.895 0.378 . . . . 10.0 111.228 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 tp -57.25 -52.45 65.27 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.007 -178.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.588 ' HB3' HD11 ' A' ' 73' ' ' LEU . 29.8 mt -59.03 -50.75 72.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.775 0.322 . . . . 10.0 110.742 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -50.08 -55.33 15.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.934 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.635 ' HB3' HD12 ' A' ' 14' ' ' ILE . 40.6 mm-40 -67.95 -49.67 60.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.983 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.719 ' HB3' HD22 ' A' ' 66' ' ' LEU . 64.7 mt -58.86 -45.4 90.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.613 0.227 . . . . 10.0 111.613 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.64 -36.72 93.65 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.616 -0.802 . . . . 10.0 111.15 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -73.59 -28.02 61.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.938 0.399 . . . . 10.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 68' ' ' GLU . 69.4 mmtt -66.81 -25.93 66.69 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.87 0.367 . . . . 10.0 110.689 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.437 HD11 ' CB ' ' A' ' 66' ' ' LEU . 21.5 mt -90.48 -4.62 56.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.313 179.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.77 -0.633 . . . . 10.0 110.205 179.739 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 O5'-C5'-C4' 109.235 -0.69 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.457 ' H71' ' O ' ' A' ' 43' ' ' THR . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 101.368 -0.952 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 3' ' ' ' DT' . . . . . 0.421 " H1'" ' O ' ' A' ' 51' ' ' MET . . . . . . . . 0 O4'--C1' 1.408 -0.942 0 O4'-C1'-C2' 104.15 -1.772 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.794 ' H71' ' HB3' ' A' ' 5' ' ' LEU . . . . . . . . 0 C4'--C3' 1.519 -0.877 0 O4'-C4'-C3' 103.507 -2.093 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . 0.578 ' H3 ' ' NH1' ' A' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.92 0 O4'-C4'-C3' 103.56 -2.04 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.816 ' OP1' " H4'" ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.749 0 C5'-C4'-O4' 113.042 2.276 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 101.184 -1.083 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C3'-C2'-C1' 101.373 -0.948 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 12' ' ' ' DT' . . . . . 0.43 H2'' " O5'" ' C' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 101.665 -0.739 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 13' ' ' ' DT' . . . . . 0.43 " O5'" H2'' ' C' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.818 0 O4'-C1'-C2' 104.419 -1.528 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.779 ' H71' ' HB3' ' B' ' 5' ' ' LEU . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 O4'-C4'-C3' 103.457 -2.143 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.532 ' H3 ' ' NH1' ' B' ' 42' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 O4'-C4'-C3' 103.63 -1.97 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . 0.825 ' OP1' " H4'" ' C' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.43 0.732 0 C5'-C4'-O4' 113.114 2.321 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . 0.481 ' H72' ' CH2' ' B' ' 32' ' ' TRP . . . . . . . . 0 O5'--C5' 1.425 -0.937 0 C3'-C2'-C1' 101.153 -1.105 . . . . 10.0 . . . . . . . . . . 1 1 . 1 stop_ save_